AKos
Consulting & Solutions GmbH
a chemoinformatics company

 

 

AKos
Consulting & Solutions GmbH
a chemoinformatics company

 

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Mesoionic Compounds in AKos Samples

AKOS_NUMBER MOLWEIGHT MOLFORMULA INCHIKEY INCHI SMILES MDLNUMBER
AKOS005219534 238.263 C10 H10 N2 O3 S ZTEPCHWHTSPDPN-UHFFFAOYSA-N InChI=1S/C10H10N2O3S/c1-14-8-5-3-7(4-6-8)12-9(16-2)10(13)15-11-12/h3-6H,1-2H3 COc1ccc(cc1)[n+]2c(c(on2)[O-])SC  
AKOS005219728 222.197 C10 H10 N2 O4 SFWOVEPTDHBNHA-UHFFFAOYSA-N InChI=1S/C10H10N2O4/c1-15-8-4-2-7(3-5-8)12-9(6-13)10(14)16-11-12/h2-5,13H,6H2,1H3 COc1ccc(cc1)[n+]2c(c(on2)[O-])CO  
AKOS005219550 254.262 C10 H10 N2 O4 S JDEQYCUQJUQVLO-UHFFFAOYSA-N InChI=1S/C10H10N2O4S/c1-12-9(10(14)16-11-12)8(13)6-17-5-7-3-2-4-15-7/h2-4H,5-6H2,1H3 C[n+]1c(c(on1)[O-])C(=O)CSCc2ccco2  
AKOS005219756 218.212 C10 H10 N4 O2 MIPWCUNCKCTMLV-UHFFFAOYSA-O InChI=1S/C10H9N4O2/c1-14-9(10(15)16-13-14)7-11-12-8-5-3-2-4-6-8/h2-7H,1H3/q-1/p+1 C[n+]1c(c(on1)[O-])/C=N/Nc2ccccc2  
AKOS005252418 250.277 C10 H10 N4 O2 S ZUZDGWQBWVFHMD-UHFFFAOYSA-N InChI=1S/C10H10N4O2S/c1-14-6-9(16-13-14)12-8(15)7-17-10-4-2-3-5-11-10/h2-6H,7H2,1H3 C[n+]1cc(on1)[N-]C(=O)CSc2ccccn2  
AKOS005250548 298.275 C10 H10 N4 O5 S TYXOXTKKHIMSSS-UHFFFAOYSA-N InChI=1S/C10H10N4O5S/c1-14-8(10(16)19-13-14)9(15)12-6-2-4-7(5-3-6)20(11,17)18/h2-5H,1H3,(H3-,11,12,13,15,16,17,18) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)S(=O)(=O)N  
AKOS005215619 324.213 C10 H11 F3 N4 O5 APPQZYHNQXUJPW-UHFFFAOYSA-N InChI=1S/C10H11F3N4O5/c1-20-8(18)6-7(14-9(19)10(11,12)13)22-15-17(6)16-2-4-21-5-3-16/h2-5H2,1H3 COC(=O)c1c(on[n+]1N2CCOCC2)[N-]C(=O)C(F)(F)F  
AKOS005214220 205.213 C10 H11 N3 O2 FBBYJCDLIRYFQS-UHFFFAOYSA-N InChI=1S/C10H11N3O2/c1-7-2-4-8(5-3-7)13-9(6-11)10(14)15-12-13/h2-5H,6,11H2,1H3 Cc1ccc(cc1)[n+]2c(c(on2)[O-])CN  
AKOS005219850 205.213 C10 H11 N3 O2 NUJVFICOVYOOBO-UHFFFAOYSA-N InChI=1S/C10H11N3O2/c1-11-7-9-10(14)15-12-13(9)8-5-3-2-4-6-8/h2-6,11H,7H2,1H3 CNCc1c(on[n+]1c2ccccc2)[O-]  
AKOS005214219 221.213 C10 H11 N3 O3 FFOMVKNUBOTKOE-UHFFFAOYSA-N InChI=1S/C10H11N3O3/c1-15-8-4-2-7(3-5-8)13-9(6-11)10(14)16-12-13/h2-5H,6,11H2,1H3 COc1ccc(cc1)[n+]2c(c(on2)[O-])CN  
AKOS005250368 253.278 C10 H11 N3 O3 S FFOMOMRRLSMNML-UHFFFAOYSA-N InChI=1S/C10H11N3O3S/c1-12(9(14)7-3-4-17-6-7)5-8-10(15)16-11-13(8)2/h3-4,6H,5H2,1-2H3 C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccsc2  
AKOS005250376 253.278 C10 H11 N3 O3 S WHWOZAYFCVSKOC-UHFFFAOYSA-N InChI=1S/C10H11N3O3S/c1-12(9(14)8-4-3-5-17-8)6-7-10(15)16-11-13(7)2/h3-5H,6H2,1-2H3 C[n+]1c(c(on1)[O-])CN(C)C(=O)c2cccs2  
AKOS005252577 253.278 C10 H11 N3 O3 S MBEFTNDPWQOWJZ-UHFFFAOYSA-N InChI=1S/C10H11N3O3S/c1-13-5-10(16-12-13)11-9(14)7-17-6-8-3-2-4-15-8/h2-5H,6-7H2,1H3 C[n+]1cc(on1)[N-]C(=O)CSCc2ccco2  
AKOS005250353 237.212 C10 H11 N3 O4 HGFGUVQMEABCAC-UHFFFAOYSA-N InChI=1S/C10H11N3O4/c1-12(9(14)8-4-3-5-16-8)6-7-10(15)17-11-13(7)2/h3-5H,6H2,1-2H3 C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccco2  
AKOS005252504 265.292 C10 H11 N5 O2 S PQZOKOKLUFFHJZ-UHFFFAOYSA-N InChI=1S/C10H11N5O2S/c1-2-15-6-9(17-14-15)13-8(16)7-18-10-11-4-3-5-12-10/h3-6H,2,7H2,1H3 CC[n+]1cc(on1)[N-]C(=O)CSc2ncccn2  
AKOS005252435 297.29 C10 H11 N5 O4 S HWFXQWTYLAWYHK-UHFFFAOYSA-N InChI=1S/C10H11N5O4S/c1-2-15-4-9(19-14-15)11-8(18)5-20-10-12-6(16)3-7(17)13-10/h3-4H,2,5H2,1H3,(H2-,11,12,13,14,16,17,18) CC[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)O)O  
AKOS005215540 225.675 C10 H12 N3 O . Cl DUAACMOYGFVUSI-UHFFFAOYSA-M InChI=1S/C10H12N3O.ClH/c1-8-2-4-9(5-3-8)6-13-7-10(11)14-12-13;/h2-5,7H,6,11H2,1H3;1H/q+1;/p-1 Cc1ccc(cc1)C[n+]2cc(on2)N.[Cl-]  
AKOS005215553 225.675 C10 H12 N3 O . Cl LQLYKYOWYDQPRA-UHFFFAOYSA-M InChI=1S/C10H12N3O.ClH/c11-10-8-13(12-14-10)7-6-9-4-2-1-3-5-9;/h1-5,8H,6-7,11H2;1H/q+1;/p-1 c1ccc(cc1)CC[n+]2cc(on2)N.[Cl-]  
AKOS005215505 241.674 C10 H12 N3 O2 . Cl OOQOXYZFEPHOTN-UHFFFAOYSA-M InChI=1S/C10H12N3O2.ClH/c1-13-9(10(11)15-12-13)7-4-3-5-8(6-7)14-2;/h3-6H,11H2,1-2H3;1H/q+1;/p-1 C[n+]1c(c(on1)N)c2cccc(c2)OC.[Cl-] MFCD09881677
AKOS005215551 241.674 C10 H12 N3 O2 . Cl AAOCFUAPJJABEH-UHFFFAOYSA-M InChI=1S/C10H12N3O2.ClH/c1-14-9-4-2-8(3-5-9)6-13-7-10(11)15-12-13;/h2-5,7H,6,11H2,1H3;1H/q+1;/p-1 COc1ccc(cc1)C[n+]2cc(on2)N.[Cl-]  
AKOS005214300 220.228 C10 H12 N4 O2 VTEOJOTVNBWORY-UHFFFAOYSA-N InChI=1S/C10H12N4O2/c1-14-9(10(15)16-13-14)7-12-6-8-3-2-4-11-5-8/h2-5,12H,6-7H2,1H3 C[n+]1c(c(on1)[O-])CNCc2cccnc2  
AKOS005252674 280.306 C10 H12 N6 O2 S MLLCXFDMEOAKNE-UHFFFAOYSA-N InChI=1S/C10H12N6O2S/c1-15(2)16-6-9(18-14-16)13-8(17)7-19-10-11-4-3-5-12-10/h3-6H,7H2,1-2H3 CN(C)[n+]1cc(on1)[N-]C(=O)CSc2ncccn2  
AKOS005252679 312.305 C10 H12 N6 O4 S SWBMSPOMTCFWFP-UHFFFAOYSA-N InChI=1S/C10H12N6O4S/c1-15(2)16-4-9(20-14-16)11-8(19)5-21-10-12-6(17)3-7(18)13-10/h3-4H,5H2,1-2H3,(H2-,11,12,13,14,17,18,19) CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)O)O  
AKOS005219566 303.358 C10 H13 N3 O4 S2 YMGTYOKSKVJORI-UHFFFAOYSA-N InChI=1S/C10H13N3O4S2/c1-12-8(9(15)17-11-12)7(14)6-19-10(18)13-2-4-16-5-3-13/h2-6H2,1H3 C[n+]1c(c(on1)[O-])C(=O)CSC(=S)N2CCOCC2  
AKOS005219552 267.308 C10 H13 N5 O2 S DBEVHULAEQPBKF-UHFFFAOYSA-N InChI=1S/C10H13N5O2S/c1-3-15-6-9(17-13-15)12-8(16)7-18-10-11-4-5-14(10)2/h4-6H,3,7H2,1-2H3 CC[n+]1cc(on1)[N-]C(=O)CSc2nccn2C  
AKOS005252833 299.373 C10 H13 N5 O2 S2 ASMQEKFXDWJGAA-UHFFFAOYSA-N InChI=1S/C10H13N5O2S2/c1-6(2)15-4-9(17-14-15)11-8(16)5-18-10-13-12-7(3)19-10/h4,6H,5H2,1-3H3 Cc1nnc(s1)SCC(=O)[N-]c2c[n+](no2)C(C)C  
AKOS005253410 315.372 C10 H13 N5 O3 S2 JZDYZCJABADPOC-UHFFFAOYSA-N InChI=1S/C10H13N5O3S2/c1-7-12-13-10(20-7)19-6-8(16)11-9-5-15(14-18-9)3-4-17-2/h5H,3-4,6H2,1-2H3 Cc1nnc(s1)SCC(=O)[N-]c2c[n+](no2)CCOC  
AKOS005252514 295.321 C10 H13 N7 O2 S SSRREHNMJCRRMX-UHFFFAOYSA-N InChI=1S/C10H13N7O2S/c1-2-17-4-9(19-16-17)15-8(18)5-20-10-13-6(11)3-7(12)14-10/h3-4H,2,5H2,1H3,(H4-,11,12,13,14,15,16,18) CC[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)N)N  
AKOS005252827 295.321 C10 H13 N7 O2 S RNPDZJLZHQLUBC-UHFFFAOYSA-N InChI=1S/C10H13N7O2S/c1-6(2)17-3-8(19-16-17)14-7(18)4-20-10-13-5-12-9(11)15-10/h3,5-6H,4H2,1-2H3,(H2-,11,12,13,14,15,16,18) CC(C)[n+]1cc(on1)[N-]C(=O)CSc2ncnc(n2)N  
AKOS005253398 311.32 C10 H13 N7 O3 S ZNUZYIJLXHEJGQ-UHFFFAOYSA-N InChI=1S/C10H13N7O3S/c1-19-3-2-17-4-8(20-16-17)14-7(18)5-21-10-13-6-12-9(11)15-10/h4,6H,2-3,5H2,1H3,(H2-,11,12,13,14,15,16,18) COCC[n+]1cc(on1)[N-]C(=O)CSc2ncnc(n2)N  
AKOS005252937 343.385 C10 H13 N7 O3 S2 OZSDUEISAAUWFY-UHFFFAOYSA-N InChI=1S/C10H13N7O3S2/c11-9-13-14-10(22-9)21-6-7(18)12-8-5-17(15-20-8)16-1-3-19-4-2-16/h5H,1-4,6H2,(H2-,11,12,13,15,18) c1c(on[n+]1N2CCOCC2)[N-]C(=O)CSc3nnc(s3)N  
AKOS005215517 288.141 C10 H14 Br N3 O2 BACNLGMVMXCDPC-UHFFFAOYSA-N InChI=1S/C10H14BrN3O2/c11-6-9(15)12-10-7-14(13-16-10)8-4-2-1-3-5-8/h7-8H,1-6H2 c1c(on[n+]1C2CCCCC2)[N-]C(=O)CBr  
AKOS005215669 243.69 C10 H14 Cl N3 O2 BYQUTGIJQMQQKN-UHFFFAOYSA-N InChI=1S/C10H14ClN3O2/c11-6-9(15)12-10-7-14(13-16-10)8-4-2-1-3-5-8/h7-8H,1-6H2 c1c(on[n+]1C2CCCCC2)[N-]C(=O)CCl  
AKOS005252832 286.374 C10 H14 N4 O2 S2 CWXLXPURLFEEGC-UHFFFAOYSA-N InChI=1S/C10H14N4O2S2/c1-7(2)14-5-9(16-13-14)12-8(15)6-18-10-11-3-4-17-10/h5,7H,3-4,6H2,1-2H3 CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=NCCS2  
AKOS005215651 238.243 C10 H14 N4 O3 HDHMAGCWVHOVER-UHFFFAOYSA-N InChI=1S/C10H14N4O3/c1-8(16)11-10-9(7-15)14(12-17-10)13-5-3-2-4-6-13/h7H,2-6H2,1H3 CC(=O)[N-]c1c([n+](no1)N2CCCCC2)C=O  
AKOS005253409 302.373 C10 H14 N4 O3 S2 IMSLSGAJJUGXLD-UHFFFAOYSA-N InChI=1S/C10H14N4O3S2/c1-16-4-3-14-6-9(17-13-14)12-8(15)7-19-10-11-2-5-18-10/h6H,2-5,7H2,1H3 COCC[n+]1cc(on1)[N-]C(=O)CSC2=NCCS2  
AKOS005214874 254.243 C10 H14 N4 O4 VYLKPGJZMUWOOY-UHFFFAOYSA-N InChI=1S/C10H14N4O4/c1-7(15)9-10(11-8(2)16)18-12-14(9)13-3-5-17-6-4-13/h3-6H2,1-2H3 CC(=O)c1c(on[n+]1N2CCOCC2)[N-]C(=O)C  
AKOS005219458 282.322 C10 H14 N6 O2 S OFYNMIXVPLNHEB-UHFFFAOYSA-N InChI=1S/C10H14N6O2S/c1-7(2)16-4-9(18-14-16)12-8(17)5-19-10-13-11-6-15(10)3/h4,6-7H,5H2,1-3H3 CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nncn2C  
AKOS005252673 282.322 C10 H14 N6 O2 S FWNUQQGPAILQLO-UHFFFAOYSA-N InChI=1S/C10H14N6O2S/c1-14(2)16-6-9(18-13-16)12-8(17)7-19-10-11-4-5-15(10)3/h4-6H,7H2,1-3H3 Cn1ccnc1SCC(=O)[N-]c2c[n+](no2)N(C)C  
AKOS005252678 310.336 C10 H14 N8 O2 S UKCMCHIPUCCSRC-UHFFFAOYSA-N InChI=1S/C10H14N8O2S/c1-17(2)18-4-9(20-16-18)15-8(19)5-21-10-13-6(11)3-7(12)14-10/h3-4H,5H2,1-2H3,(H4-,11,12,13,14,15,16,19) CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)N)N  
AKOS005214962 258.705 C10 H15 Cl N4 O2 IBTPSDHEDPEMGD-UHFFFAOYSA-N InChI=1S/C10H15ClN4O2/c1-8(16)12-10-9(7-11)15(13-17-10)14-5-3-2-4-6-14/h2-7H2,1H3 CC(=O)[N-]c1c([n+](no1)N2CCCCC2)CCl  
AKOS005215709 274.704 C10 H15 Cl N4 O3 OHELCGWWJSCLCW-UHFFFAOYSA-N InChI=1S/C10H15ClN4O3/c11-7-9(16)12-10-8-15(13-18-10)2-1-14-3-5-17-6-4-14/h8H,1-7H2 c1c(on[n+]1CCN2CCOCC2)[N-]C(=O)CCl  
AKOS005215737 209.245 C10 H15 N3 O2 IYGGSYLXFDKOFN-UHFFFAOYSA-N InChI=1S/C10H15N3O2/c1-8(14)11-10-7-13(12-15-10)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3 CC(=O)[N-]c1c[n+](no1)C2CCCCC2 MFCD00452403
AKOS005215590 225.244 C10 H15 N3 O3 KLPDZHNPAGNHKA-UHFFFAOYSA-N InChI=1S/C10H15N3O3/c1-10(2,3)15-9(14)11-8-6-13(12-16-8)7-4-5-7/h6-7H,4-5H2,1-3H3 CC(C)(C)OC(=O)[N-]c1c[n+](no1)C2CC2  
AKOS005215641 225.244 C10 H15 N3 O3 QKPDAALXIFRNMY-UHFFFAOYSA-N InChI=1S/C10H15N3O3/c1-5-6-13-7-8(16-12-13)11-9(14)15-10(2,3)4/h5,7H,1,6H2,2-4H3 CC(C)(C)OC(=O)[N-]c1c[n+](no1)CC=C  
AKOS005250367 225.244 C10 H15 N3 O3 LAFZOBWUUMOOGB-UHFFFAOYSA-N InChI=1S/C10H15N3O3/c1-12(9(14)7-4-3-5-7)6-8-10(15)16-11-13(8)2/h7H,3-6H2,1-2H3 C[n+]1c(c(on1)[O-])CN(C)C(=O)C2CCC2  
AKOS005219473 257.243 C10 H15 N3 O5 VXVRDXGWMALHRE-UHFFFAOYSA-N InChI=1S/C10H15N3O5/c1-5-13-7(6-14)8(17-12-13)11-18-9(15)16-10(2,3)4/h6H,5H2,1-4H3 CC[n+]1c(c(on1)[N-]OC(=O)OC(C)(C)C)C=O  
AKOS005214909 240.259 C10 H16 N4 O3 CJGVVIRGJMEYSS-UHFFFAOYSA-N InChI=1S/C10H16N4O3/c1-8(16)11-10-9(7-15)14(12-17-10)13-5-3-2-4-6-13/h15H,2-7H2,1H3 CC(=O)[N-]c1c([n+](no1)N2CCCCC2)CO  
AKOS005215568 240.259 C10 H16 N4 O3 ZIAUIQOJLYSFGL-UHFFFAOYSA-N InChI=1S/C10H16N4O3/c1-9(15)11-10-8-14(12-17-10)3-2-13-4-6-16-7-5-13/h8H,2-7H2,1H3 CC(=O)[N-]c1c[n+](no1)CCN2CCOCC2  
AKOS005215012 256.258 C10 H16 N4 O4 CVKFRZHNMGIKRB-UHFFFAOYSA-N InChI=1S/C10H16N4O4/c1-7(15)9-10(11-8(2)16)18-12-14(9)13-3-5-17-6-4-13/h7,15H,3-6H2,1-2H3 CC(c1c(on[n+]1N2CCOCC2)[N-]C(=O)C)O  
AKOS005214239 211.261 C10 H17 N3 O2 PANUZPWIAFCUSW-UHFFFAOYSA-N InChI=1S/C10H17N3O2/c1-13-9(10(14)15-12-13)7-11-8-5-3-2-4-6-8/h8,11H,2-7H2,1H3 C[n+]1c(c(on1)[O-])CNC2CCCCC2  
AKOS005219479 211.261 C10 H17 N3 O2 CSOHHNATRLMBCT-UHFFFAOYSA-N InChI=1S/C10H17N3O2/c1-7(2)13-6-8(15-12-13)11-9(14)10(3,4)5/h6-7H,1-5H3 CC(C)[n+]1cc(on1)[N-]C(=O)C(C)(C)C  
AKOS005215565 227.26 C10 H17 N3 O3 NTHTYLYTLNKACV-UHFFFAOYSA-N InChI=1S/C10H17N3O3/c1-7(2)13-6-8(16-12-13)11-9(14)15-10(3,4)5/h6-7H,1-5H3 CC(C)[n+]1cc(on1)[N-]C(=O)OC(C)(C)C  
AKOS005250385 227.26 C10 H17 N3 O3 ALXUTTFEIICCHH-UHFFFAOYSA-N InChI=1S/C10H17N3O3/c1-4-5-6-9(14)12(2)7-8-10(15)16-11-13(8)3/h4-7H2,1-3H3 CCCCC(=O)N(C)Cc1c(on[n+]1C)[O-]  
AKOS005219462 243.26 C10 H17 N3 O4 NORPDCXKMPSPMO-UHFFFAOYSA-N InChI=1S/C10H17N3O4/c1-7(2)13-6-8(16-12-13)11-17-9(14)15-10(3,4)5/h6-7H,1-5H3 CC(C)[n+]1cc(on1)[N-]OC(=O)OC(C)(C)C  
AKOS005215048 239.274 C10 H17 N5 O2 DVWNUBLFBOJJRM-UHFFFAOYSA-N InChI=1S/C10H17N5O2/c1-8(16)12-10-9(7-11)15(13-17-10)14-5-3-2-4-6-14/h2-7,11H2,1H3 CC(=O)[N-]c1c([n+](no1)N2CCCCC2)CN  
AKOS005214931 255.274 C10 H17 N5 O3 JQCQFMARNMDXDZ-UHFFFAOYSA-N InChI=1S/C10H17N5O3/c1-8(16)12-10-9(7-11-2)15(13-18-10)14-3-5-17-6-4-14/h11H,3-7H2,1-2H3 CC(=O)[N-]c1c([n+](no1)N2CCOCC2)CNC  
AKOS005214301 242.275 C10 H18 N4 O3 HJZYDDKGKPBKIH-UHFFFAOYSA-N InChI=1S/C10H18N4O3/c1-13-9(10(15)17-12-13)8-11-2-3-14-4-6-16-7-5-14/h11H,2-8H2,1H3 C[n+]1c(c(on1)[O-])CNCCN2CCOCC2  
AKOS005214303 242.275 C10 H18 N4 O3 PQMVNQLYHUGOEH-UHFFFAOYSA-N InChI=1S/C10H18N4O3/c1-8(2)14-9(10(15)17-12-14)7-11-13-3-5-16-6-4-13/h8,11H,3-7H2,1-2H3 CC(C)[n+]1c(c(on1)[O-])CNN2CCOCC2  
AKOS005214244 213.277 C10 H19 N3 O2 MDYVULBGGZOHOF-UHFFFAOYSA-N InChI=1S/C10H19N3O2/c1-5-8(4)11-6-9-10(14)15-12-13(9)7(2)3/h7-8,11H,5-6H2,1-4H3 CCC(C)NCc1c(on[n+]1C(C)C)[O-]  
AKOS005214245 213.277 C10 H19 N3 O2 CSBPBPMDHWKFCJ-UHFFFAOYSA-N InChI=1S/C10H19N3O2/c1-7(2)13-8(9(14)15-12-13)6-11-10(3,4)5/h7,11H,6H2,1-5H3 CC(C)[n+]1c(c(on1)[O-])CNC(C)(C)C  
AKOS005214317 229.276 C10 H19 N3 O3 ARLPDIVFJOHBNJ-UHFFFAOYSA-N InChI=1S/C10H19N3O3/c1-8(2)13-9(10(14)16-12-13)7-11-5-4-6-15-3/h8,11H,4-7H2,1-3H3 CC(C)[n+]1c(c(on1)[O-])CNCCCOC  
AKOS005214267 245.276 C10 H19 N3 O4 VQIYUZBIJRSQAP-UHFFFAOYSA-N InChI=1S/C10H19N3O4/c1-7(2)13-8(10(14)17-12-13)5-11-6-9(15-3)16-4/h7,9,11H,5-6H2,1-4H3 CC(C)[n+]1c(c(on1)[O-])CNCC(OC)OC  
AKOS005214305 228.291 C10 H20 N4 O2 YANDEPAZBYLOHY-UHFFFAOYSA-N InChI=1S/C10H20N4O2/c1-8(2)14-9(10(15)16-12-14)7-11-5-6-13(3)4/h8,11H,5-7H2,1-4H3 CC(C)[n+]1c(c(on1)[O-])CNCCN(C)C  
AKOS005215715 316.132 C10 H3 F7 N2 O2 GZLLOUMJOQNIOJ-UHFFFAOYSA-N InChI=1S/C10H3F7N2O2/c1-19-8(9(20)21-18-19)2-4(11)6(13)3(10(15,16)17)7(14)5(2)12/h1H3 C[n+]1c(c(on1)[O-])c2c(c(c(c(c2F)F)C(F)(F)F)F)F  
AKOS005250549 291.159 C10 H5 F4 N3 O3 HKEPWASSBQDAKD-UHFFFAOYSA-N InChI=1S/C10H5F4N3O3/c1-17-8(10(19)20-16-17)9(18)15-7-5(13)3(11)2-4(12)6(7)14/h2H,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])C(=O)Nc2c(c(cc(c2F)F)F)F  
AKOS005250635 316.083 C10 H7 Br F N3 O3 FVWKDBBWDKSETH-UHFFFAOYSA-N InChI=1S/C10H7BrFN3O3/c1-15-8(10(17)18-14-15)9(16)13-7-3-2-5(11)4-6(7)12/h2-4H,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2F)Br  
AKOS005250647 271.632 C10 H7 Cl F N3 O3 XMUSUHVYFYXFKX-UHFFFAOYSA-N InChI=1S/C10H7ClFN3O3/c1-15-8(10(17)18-14-15)9(16)13-5-2-3-7(12)6(11)4-5/h2-4H,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c(c2)Cl)F  
AKOS005250508 288.087 C10 H7 Cl2 N3 O3 QJLKFWVTGPJKSK-UHFFFAOYSA-N InChI=1S/C10H7Cl2N3O3/c1-15-8(10(17)18-14-15)9(16)13-7-3-2-5(11)4-6(7)12/h2-4H,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2Cl)Cl  
AKOS005250509 288.087 C10 H7 Cl2 N3 O3 NNLIINMKZDXIGB-UHFFFAOYSA-N InChI=1S/C10H7Cl2N3O3/c1-15-8(10(17)18-14-15)9(16)13-7-4-5(11)2-3-6(7)12/h2-4H,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2cc(ccc2Cl)Cl  
AKOS005250510 288.087 C10 H7 Cl2 N3 O3 DJLSLYPVXAAOAB-UHFFFAOYSA-N InChI=1S/C10H7Cl2N3O3/c1-15-8(10(17)18-14-15)9(16)13-5-2-3-6(11)7(12)4-5/h2-4H,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c(c2)Cl)Cl  
AKOS005250637 288.087 C10 H7 Cl2 N3 O3 YYAMOYSULSCRKO-UHFFFAOYSA-N InChI=1S/C10H7Cl2N3O3/c1-15-8(10(17)18-14-15)9(16)13-7-3-5(11)2-6(12)4-7/h2-4H,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2cc(cc(c2)Cl)Cl  
AKOS005250659 288.087 C10 H7 Cl2 N3 O3 CPFZXOHVBVOSTB-UHFFFAOYSA-N InChI=1S/C10H7Cl2N3O3/c1-15-8(10(17)18-14-15)9(16)13-6-4-2-3-5(11)7(6)12/h2-4H,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2cccc(c2Cl)Cl  
AKOS005250595 255.178 C10 H7 F2 N3 O3 HFUREOQROQGKKZ-UHFFFAOYSA-N InChI=1S/C10H7F2N3O3/c1-15-8(10(17)18-14-15)9(16)13-5-2-3-6(11)7(12)4-5/h2-4H,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c(c2)F)F  
AKOS005251273 233.246 C10 H7 N3 O2 S ULZHGUKWFZLOLS-UHFFFAOYSA-N InChI=1S/C10H7N3O2S/c11-6-7-16-9-10(14)15-12-13(9)8-4-2-1-3-5-8/h1-5H,7H2 c1ccc(cc1)[n+]2c(c(on2)[O-])SCC#N  
AKOS005250660 263.186 C10 H7 N4 O5 SRYRENMCMYHIOL-UHFFFAOYSA-M InChI=1S/C10H8N4O5/c1-13-8(10(16)19-12-13)9(15)11-6-2-4-7(5-3-6)14(17)18/h2,4-5,16H,1H3,(H,11,15)/p-1 C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c[c-]2)[N+](=O)[O-]  
AKOS005250633 298.093 C10 H8 Br N3 O3 OTGWETXUMJOZIG-UHFFFAOYSA-N InChI=1S/C10H8BrN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-5-3-2-4-6(7)11/h2-5H,1H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2Br  
AKOS005250634 298.093 C10 H8 Br N3 O3 JJPWUMRKYYTZIE-UHFFFAOYSA-N InChI=1S/C10H8BrN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-4-2-6(11)3-5-7/h2-5H,1H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)Br  
AKOS005250636 253.642 C10 H8 Cl N3 O3 MSVYSJNKMTZSPG-UHFFFAOYSA-N InChI=1S/C10H8ClN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-5-3-2-4-6(7)11/h2-5H,1H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2Cl  
AKOS005250645 253.642 C10 H8 Cl N3 O3 NQODKALAIJBVGA-UHFFFAOYSA-N InChI=1S/C10H8ClN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-4-2-3-6(11)5-7/h2-5H,1H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])C(=O)Nc2cccc(c2)Cl  
AKOS005250646 253.642 C10 H8 Cl N3 O3 FFLRWQPQQDKTCI-UHFFFAOYSA-N InChI=1S/C10H8ClN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-4-2-6(11)3-5-7/h2-5H,1H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)Cl  
AKOS000280682 223.181 C10 H8 F N2 O3 OJZPUFJZDYUNIG-UHFFFAOYSA-O InChI=1S/C10H7FN2O3/c1-13-8(10(14)15)9(16-12-13)6-4-2-3-5-7(6)11/h2-5H,1H3/p+1 C[n+]1c(c(on1)c2ccccc2F)C(=O)O MFCD08694520
AKOS005250528 237.187 C10 H8 F N3 O3 SVFPYPXCBJPDPL-UHFFFAOYSA-N InChI=1S/C10H8FN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-5-3-2-4-6(7)11/h2-5H,1H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2F  
AKOS005250529 237.187 C10 H8 F N3 O3 INEUDUMQRQMMHM-UHFFFAOYSA-N InChI=1S/C10H8FN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-4-2-6(11)3-5-7/h2-5H,1H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)F  
AKOS005250530 345.093 C10 H8 I N3 O3 FOEXAHFNZBEVHW-UHFFFAOYSA-N InChI=1S/C10H8IN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-4-2-6(11)3-5-7/h2-5H,1H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)I  
AKOS005214204 204.182 C10 H8 N2 O3 ZUKPVIQHOHMWDM-UHFFFAOYSA-N InChI=1S/C10H8N2O3/c1-7-2-4-8(5-3-7)12-9(6-13)10(14)15-11-12/h2-6H,1H3 Cc1ccc(cc1)[n+]2c(c(on2)[O-])C=O  
AKOS005215648 204.182 C10 H8 N2 O3 SLCBVFPDMGNJOZ-UHFFFAOYSA-N InChI=1S/C10H8N2O3/c1-7(13)9-10(14)15-11-12(9)8-5-3-2-4-6-8/h2-6H,1H3 CC(=O)c1c(on[n+]1c2ccccc2)[O-] MFCD09881655
AKOS005214203 220.182 C10 H8 N2 O4 RHCYELMUONTNJP-UHFFFAOYSA-N InChI=1S/C10H8N2O4/c1-15-8-4-2-7(3-5-8)12-9(6-13)10(14)16-11-12/h2-6H,1H3 COc1ccc(cc1)[n+]2c(c(on2)[O-])C=O  
AKOS005251320 252.247 C10 H8 N2 O4 S JKPTWASJOMXVFK-UHFFFAOYSA-N InChI=1S/C10H8N2O4S/c13-8(14)6-17-9-10(15)16-11-12(9)7-4-2-1-3-5-7/h1-5H,6H2,(H-,11,13,14,15) c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)O  
AKOS005219727 236.181 C10 H8 N2 O5 QUFBARNXKRRKPJ-UHFFFAOYSA-N InChI=1S/C10H8N2O5/c1-16-7-4-2-6(3-5-7)12-8(9(13)14)10(15)17-11-12/h2-5H,1H3,(H-,11,13,14,15) COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)O  
AKOS005215698 276.275 C10 H8 N6 O2 S MOGPRXSHQMVLOZ-UHFFFAOYSA-N InChI=1S/C10H8N6O2S/c1-16-7(10(17)18-15-16)6-4(2-11)8(13)19-9(14)5(6)3-12/h6H,13-14H2,1H3 C[n+]1c(c(on1)[O-])C2C(=C(SC(=C2C#N)N)N)C#N  
AKOS005215474 203.197 C10 H9 N3 O2 GKNQWAQZDMCMEM-UHFFFAOYSA-N InChI=1S/C10H9N3O2/c1-13-7-9(15-12-13)11-10(14)8-5-3-2-4-6-8/h2-7H,1H3 C[n+]1cc(on1)[N-]C(=O)c2ccccc2  
AKOS005215602 203.197 C10 H9 N3 O2 ZFACQJOTKFZKCY-UHFFFAOYSA-N InChI=1S/C10H9N3O2/c1-8(14)11-10-7-13(12-15-10)9-5-3-2-4-6-9/h2-7H,1H3 CC(=O)[N-]c1c[n+](no1)c2ccccc2 MFCD08488685
AKOS005250505 219.197 C10 H9 N3 O3 GELWLGNXKVHWBD-UHFFFAOYSA-N InChI=1S/C10H9N3O3/c1-13-8(10(15)16-12-13)9(14)11-7-5-3-2-4-6-7/h2-6H,1H3,(H-,11,12,14,15) C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2  
AKOS005250707 251.262 C10 H9 N3 O3 S SFSUDFNDTVRBCJ-UHFFFAOYSA-N InChI=1S/C10H9N3O3S/c1-13-9(10(15)16-12-13)7(14)6-17-8-4-2-3-5-11-8/h2-5H,6H2,1H3 C[n+]1c(c(on1)[O-])C(=O)CSc2ccccn2  
AKOS005251322 251.262 C10 H9 N3 O3 S XWXLWLOMMKZFCI-UHFFFAOYSA-N InChI=1S/C10H9N3O3S/c11-8(14)6-17-9-10(15)16-12-13(9)7-4-2-1-3-5-7/h1-5H,6H2,(H2-,11,12,14,15) c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)N  
AKOS005219834 263.276 C10 H9 N5 O2 S RGFILBNUEPJOGB-UHFFFAOYSA-O InChI=1S/C10H8N5O2S/c11-10(18)13-12-6-8-9(16)17-14-15(8)7-4-2-1-3-5-7/h1-6H,(H2,11,18)/q-1/p+1 c1ccc(cc1)[n+]2c(c(on2)[O-])/C=N/NC(=S)N  
AKOS005251323 344.184 C11 H10 Br N3 O3 S RWLGCEQNYWJUSL-UHFFFAOYSA-N InChI=1S/C11H10BrN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-5-3-2-4-7(8)12/h2-5H,6H2,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2Br  
AKOS005251324 344.184 C11 H10 Br N3 O3 S CMKHYPISOLTVDP-UHFFFAOYSA-N InChI=1S/C11H10BrN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-4-2-7(12)3-5-8/h2-5H,6H2,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)Br  
AKOS005215555 251.669 C11 H10 Cl N3 O2 NFHSXEFRDWAMOX-UHFFFAOYSA-N InChI=1S/C11H10ClN3O2/c1-8(16)13-11-7-15(14-17-11)6-9-4-2-3-5-10(9)12/h2-5,7H,6H2,1H3 CC(=O)[N-]c1c[n+](no1)Cc2ccccc2Cl  
AKOS005215670 251.669 C11 H10 Cl N3 O2 BFFQYUKDDONXLG-UHFFFAOYSA-N InChI=1S/C11H10ClN3O2/c12-6-10(16)13-11-8-15(14-17-11)7-9-4-2-1-3-5-9/h1-5,8H,6-7H2 c1ccc(cc1)C[n+]2cc(on2)[N-]C(=O)CCl  
AKOS005252640 283.734 C11 H10 Cl N3 O2 S KEGKKVJXBQJMDC-UHFFFAOYSA-N InChI=1S/C11H10ClN3O2S/c1-15-6-11(17-14-15)13-10(16)7-18-9-4-2-8(12)3-5-9/h2-6H,7H2,1H3 C[n+]1cc(on1)[N-]C(=O)CSc2ccc(cc2)Cl  
AKOS005250648 267.668 C11 H10 Cl N3 O3 UXYQSDDHAZOFMA-UHFFFAOYSA-N InChI=1S/C11H10ClN3O3/c1-6-7(12)4-3-5-8(6)13-10(16)9-11(17)18-14-15(9)2/h3-5H,1-2H3,(H-,13,14,16,17) Cc1c(cccc1Cl)NC(=O)c2c(on[n+]2C)[O-]  
AKOS005250657 267.668 C11 H10 Cl N3 O3 LHFOHTLPSSSBDS-UHFFFAOYSA-N InChI=1S/C11H10ClN3O3/c1-6-3-4-7(5-8(6)12)13-10(16)9-11(17)18-14-15(9)2/h3-5H,1-2H3,(H-,13,14,16,17) Cc1ccc(cc1Cl)NC(=O)c2c(on[n+]2C)[O-]  
AKOS005250658 267.668 C11 H10 Cl N3 O3 HKZNWRGDAGNYBS-UHFFFAOYSA-N InChI=1S/C11H10ClN3O3/c1-6-3-4-7(12)5-8(6)13-10(16)9-11(17)18-14-15(9)2/h3-5H,1-2H3,(H-,13,14,16,17) Cc1ccc(cc1NC(=O)c2c(on[n+]2C)[O-])Cl  
AKOS005251350 299.733 C11 H10 Cl N3 O3 S TUZIUPMPUOPDPK-UHFFFAOYSA-N InChI=1S/C11H10ClN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-5-3-2-4-7(8)12/h2-5H,6H2,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2Cl  
AKOS005251351 299.733 C11 H10 Cl N3 O3 S WLMIZBLFBACNRV-UHFFFAOYSA-N InChI=1S/C11H10ClN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-4-2-3-7(12)5-8/h2-5H,6H2,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCC(=O)Nc2cccc(c2)Cl  
AKOS005251352 299.733 C11 H10 Cl N3 O3 S PGQSOUZNWBFIPE-UHFFFAOYSA-N InChI=1S/C11H10ClN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-4-2-7(12)3-5-8/h2-5H,6H2,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)Cl  
AKOS005250542 283.668 C11 H10 Cl N3 O4 REWUUSRMAUXJSL-UHFFFAOYSA-N InChI=1S/C11H10ClN3O4/c1-15-9(11(17)19-14-15)10(16)13-6-3-4-8(18-2)7(12)5-6/h3-5H,1-2H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c(c2)Cl)OC  
AKOS005250543 283.668 C11 H10 Cl N3 O4 DLOXUAVYVADNER-UHFFFAOYSA-N InChI=1S/C11H10ClN3O4/c1-15-9(11(17)19-14-15)10(16)13-7-5-6(12)3-4-8(7)18-2/h3-5H,1-2H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2cc(ccc2OC)Cl  
AKOS005215542 235.214 C11 H10 F N3 O2 GHOOZJTYKMXOSW-UHFFFAOYSA-N InChI=1S/C11H10FN3O2/c1-8(16)13-11-7-15(14-17-11)6-9-2-4-10(12)5-3-9/h2-5,7H,6H2,1H3 CC(=O)[N-]c1c[n+](no1)Cc2ccc(cc2)F  
AKOS005251225 283.279 C11 H10 F N3 O3 S OCSFSMQLOJPIJJ-UHFFFAOYSA-N InChI=1S/C11H10FN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-5-3-2-4-7(8)12/h2-5H,6H2,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2F  
AKOS005251235 283.279 C11 H10 F N3 O3 S BSTDNPHWIJTRHM-UHFFFAOYSA-N InChI=1S/C11H10FN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-4-2-7(12)3-5-8/h2-5H,6H2,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)F  
AKOS005251236 391.185 C11 H10 I N3 O3 S DXXUEDXIEULABA-UHFFFAOYSA-N InChI=1S/C11H10IN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-4-2-7(12)3-5-8/h2-5H,6H2,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)I  
AKOS005219526 250.274 C11 H10 N2 O3 S FZEUSJWSUVEWRS-UHFFFAOYSA-N InChI=1S/C11H10N2O3S/c1-13-10(11(15)16-12-13)9(14)7-17-8-5-3-2-4-6-8/h2-6H,7H2,1H3 C[n+]1c(c(on1)[O-])C(=O)CSc2ccccc2  
AKOS005215725 234.208 C11 H10 N2 O4 NWEVGACLUMJFMD-UHFFFAOYSA-N InChI=1S/C11H10N2O4/c1-16-9(14)7-13-10(11(15)17-12-13)8-5-3-2-4-6-8/h2-6H,7H2,1H3 COC(=O)C[n+]1c(c(on1)[O-])c2ccccc2 MFCD09881650
AKOS005219535 282.272 C11 H10 N2 O5 S QMFOWNZSPSDXRO-UHFFFAOYSA-N InChI=1S/C11H10N2O5S/c1-17-8-4-2-7(3-5-8)13-10(11(16)18-12-13)19-6-9(14)15/h2-5H,6H2,1H3,(H-,12,14,15,16) COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)O  
AKOS005250557 262.222 C11 H10 N4 O4 KCLVYJNWUBXFCM-UHFFFAOYSA-N InChI=1S/C11H10N4O4/c1-15-8(11(18)19-14-15)10(17)13-7-4-2-6(3-5-7)9(12)16/h2-5H,1H3,(H3-,12,13,14,16,17,18) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)C(=O)N  
AKOS005250558 262.222 C11 H10 N4 O4 OHNGXQLMBUHQJH-UHFFFAOYSA-N InChI=1S/C11H10N4O4/c1-15-8(11(18)19-14-15)10(17)13-7-5-3-2-4-6(7)9(12)16/h2-5H,1H3,(H3-,12,13,14,16,17,18) C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2C(=O)N  
AKOS005250532 278.221 C11 H10 N4 O5 CFTUEXSFUJDBKL-UHFFFAOYSA-N InChI=1S/C11H10N4O5/c1-6-5-7(15(18)19)3-4-8(6)12-10(16)9-11(17)20-13-14(9)2/h3-5H,1-2H3,(H-,12,13,16,17) Cc1cc(ccc1NC(=O)c2c(on[n+]2C)[O-])[N+](=O)[O-]  
AKOS005250533 278.221 C11 H10 N4 O5 GUGDQFWCSXWREF-UHFFFAOYSA-N InChI=1S/C11H10N4O5/c1-6-3-4-7(15(18)19)5-8(6)12-10(16)9-11(17)20-13-14(9)2/h3-5H,1-2H3,(H-,12,13,16,17) Cc1ccc(cc1NC(=O)c2c(on[n+]2C)[O-])[N+](=O)[O-]  
AKOS005219771 290.301 C11 H10 N6 O2 S OOZIJSBNAMMXHO-UHFFFAOYSA-N InChI=1S/C11H10N6O2S/c12-10-13-8(14-11(20)15-10)7-9(18)19-16-17(7)6-4-2-1-3-5-6/h1-5,8H,(H4-,12,13,14,15,16,18,20) c1ccc(cc1)[n+]2c(c(on2)[O-])C3NC(=NC(=N3)N)S  
AKOS005215713 217.224 C11 H11 N3 O2 FPWJFLAMLMYTID-GHXNOFRVSA-N InChI=1S/C11H11N3O2/c1-14-10(11(15)16-13-14)8-12-7-9-5-3-2-4-6-9/h2-7H,8H2,1H3/b12-7- C[n+]1c(c(on1)[O-])C/N=C\c2ccccc2  
AKOS005215738 217.224 C11 H11 N3 O2 WSYXFQCSVWUXPZ-UHFFFAOYSA-N InChI=1S/C11H11N3O2/c1-9(15)12-11-8-14(13-16-11)7-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3 CC(=O)[N-]c1c[n+](no1)Cc2ccccc2  
AKOS005219477 217.224 C11 H11 N3 O2 PGPALZKIMQUDEV-UHFFFAOYSA-N InChI=1S/C11H11N3O2/c1-2-14-8-10(16-13-14)12-11(15)9-6-4-3-5-7-9/h3-8H,2H2,1H3 CC[n+]1cc(on1)[N-]C(=O)c2ccccc2  
AKOS005252603 249.289 C11 H11 N3 O2 S KLMDEOXRDGWURV-UHFFFAOYSA-N InChI=1S/C11H11N3O2S/c1-14-7-11(16-13-14)12-10(15)8-17-9-5-3-2-4-6-9/h2-7H,8H2,1H3 C[n+]1cc(on1)[N-]C(=O)CSc2ccccc2  
AKOS005250661 233.223 C11 H11 N3 O3 BYWUBGRJKHTLIR-UHFFFAOYSA-N InChI=1S/C11H11N3O3/c1-7-5-3-4-6-8(7)12-10(15)9-11(16)17-13-14(9)2/h3-6H,1-2H3,(H-,12,13,15,16) Cc1ccccc1NC(=O)c2c(on[n+]2C)[O-]  
AKOS005250662 233.223 C11 H11 N3 O3 OAWCRPLTXQZVQT-UHFFFAOYSA-N InChI=1S/C11H11N3O3/c1-7-4-3-5-8(6-7)12-10(15)9-11(16)17-13-14(9)2/h3-6H,1-2H3,(H-,12,13,15,16) Cc1cccc(c1)NC(=O)c2c(on[n+]2C)[O-]  
AKOS005250663 233.223 C11 H11 N3 O3 NAJPNYWXEFGALI-UHFFFAOYSA-N InChI=1S/C11H11N3O3/c1-7-3-5-8(6-4-7)12-10(15)9-11(16)17-13-14(9)2/h3-6H,1-2H3,(H-,12,13,15,16) Cc1ccc(cc1)NC(=O)c2c(on[n+]2C)[O-]  
AKOS005219533 265.288 C11 H11 N3 O3 S DUNBMSXVQYUHEF-UHFFFAOYSA-N InChI=1S/C11H11N3O3S/c1-14-10(11(16)17-13-14)9(15)6-18-8-4-2-3-7(12)5-8/h2-5H,6,12H2,1H3 C[n+]1c(c(on1)[O-])C(=O)CSc2cccc(c2)N  
AKOS005251298 265.288 C11 H11 N3 O3 S POJNPBJPCAJMQX-UHFFFAOYSA-N InChI=1S/C11H11N3O3S/c1-14-10(11(16)17-13-14)18-7-9(15)12-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2  
AKOS005250524 249.223 C11 H11 N3 O4 DMDKLWAMROJEGW-UHFFFAOYSA-N InChI=1S/C11H11N3O4/c1-14-9(11(16)18-13-14)10(15)12-7-5-3-4-6-8(7)17-2/h3-6H,1-2H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2OC  
AKOS005250525 249.223 C11 H11 N3 O4 BZAXUZOEFXKVDC-UHFFFAOYSA-N InChI=1S/C11H11N3O4/c1-14-9(11(16)18-13-14)10(15)12-7-4-3-5-8(6-7)17-2/h3-6H,1-2H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])C(=O)Nc2cccc(c2)OC  
AKOS005250526 249.223 C11 H11 N3 O4 HXMNXZDHCPRQQQ-UHFFFAOYSA-N InChI=1S/C11H11N3O4/c1-14-9(11(16)18-13-14)10(15)12-7-3-5-8(17-2)6-4-7/h3-6H,1-2H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)OC  
AKOS005251265 281.288 C11 H11 N3 O4 S XXEJCEHJRCMYMP-UHFFFAOYSA-N InChI=1S/C11H11N3O4S/c1-17-8-4-2-7(3-5-8)14-10(11(16)18-13-14)19-6-9(12)15/h2-5H,6H2,1H3,(H2-,12,13,15,16) COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)N  
AKOS005215550 245.237 C11 H11 N5 O2 DHQBRMZASYKTSM-UHFFFAOYSA-N InChI=1S/C11H11N5O2/c1-7(2)16-10(4-9(5-12)6-13)11(18-15-16)14-8(3)17/h4,7H,1-3H3 CC(C)[n+]1c(c(on1)[N-]C(=O)C)C=C(C#N)C#N  
AKOS005219721 293.302 C11 H11 N5 O3 S XSGJYFBHUVDJJV-UHFFFAOYSA-O InChI=1S/C11H10N5O3S/c1-18-8-4-2-7(3-5-8)16-9(10(17)19-15-16)6-13-14-11(12)20/h2-6H,1H3,(H2,12,20)/q-1/p+1 COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=N/NC(=S)N  
AKOS005214252 253.685 C11 H12 Cl N3 O2 XAHRBWASXRFIHK-UHFFFAOYSA-N InChI=1S/C11H12ClN3O2/c1-15-10(11(16)17-14-15)7-13-6-8-4-2-3-5-9(8)12/h2-5,13H,6-7H2,1H3 C[n+]1c(c(on1)[O-])CNCc2ccccc2Cl  
AKOS005214263 237.23 C11 H12 F N3 O2 NPZUUGWAPVBPSF-UHFFFAOYSA-N InChI=1S/C11H12FN3O2/c1-15-10(11(16)17-14-15)7-13-6-8-2-4-9(12)5-3-8/h2-5,13H,6-7H2,1H3 C[n+]1c(c(on1)[O-])CNCc2ccc(cc2)F  
AKOS005215700 236.224 C11 H12 N2 O4 KFYFFTXKXMGZKY-UHFFFAOYSA-N InChI=1S/C11H12N2O4/c1-7(14)10-11(15)17-12-13(10)8-3-5-9(16-2)6-4-8/h3-7,14H,1-2H3 CC(c1c(on[n+]1c2ccc(cc2)OC)[O-])O  
AKOS005215601 232.239 C11 H12 N4 O2 YTQLQNOVEKGMRI-UHFFFAOYSA-N InChI=1S/C11H12N4O2/c1-14(2)15-8-10(17-13-15)12-11(16)9-6-4-3-5-7-9/h3-8H,1-2H3 CN(C)[n+]1cc(on1)[N-]C(=O)c2ccccc2  
AKOS005252470 264.304 C11 H12 N4 O2 S FMDBQDQVKQGWEF-UHFFFAOYSA-N InChI=1S/C11H12N4O2S/c1-15-6-11(17-14-15)13-10(16)7-18-9-4-2-3-8(12)5-9/h2-6H,7,12H2,1H3 C[n+]1cc(on1)[N-]C(=O)CSc2cccc(c2)N  
AKOS005252799 264.304 C11 H12 N4 O2 S GCGYYFNXFIIPJA-UHFFFAOYSA-N InChI=1S/C11H12N4O2S/c1-2-15-7-10(17-14-15)13-9(16)8-18-11-5-3-4-6-12-11/h3-7H,2,8H2,1H3 CC[n+]1cc(on1)[N-]C(=O)CSc2ccccn2  
AKOS005250682 280.303 C11 H12 N4 O3 S BNHGXLJYLDAIHN-UHFFFAOYSA-N InChI=1S/C11H12N4O3S/c1-6-4-7(2)13-11(12-6)19-5-8(16)9-10(17)18-14-15(9)3/h4H,5H2,1-3H3 Cc1cc(nc(n1)SCC(=O)c2c(on[n+]2C)[O-])C  
AKOS005251115 344.367 C11 H12 N4 O5 S2 PBABHIXIKDVOLY-UHFFFAOYSA-N InChI=1S/C11H12N4O5S2/c1-15-10(11(17)20-14-15)21-6-9(16)13-7-2-4-8(5-3-7)22(12,18)19/h2-5H,6H2,1H3,(H3-,12,13,14,16,17,18,19) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)S(=O)(=O)N  
AKOS005214288 219.24 C11 H13 N3 O2 VNWQAUIAWXFIAP-UHFFFAOYSA-N InChI=1S/C11H13N3O2/c1-14-10(11(15)16-13-14)8-12-7-9-5-3-2-4-6-9/h2-6,12H,7-8H2,1H3 C[n+]1c(c(on1)[O-])CNCc2ccccc2  
AKOS005215610 255.701 C11 H13 N3 O2 . Cl H OMUJSCGEYOUJRW-UHFFFAOYSA-N InChI=1S/C11H13N3O2.ClH/c1-14-10(11(15)16-13-14)8-12-7-9-5-3-2-4-6-9;/h2-6,12H,7-8H2,1H3;1H C[n+]1c(c(on1)[O-])CNCc2ccccc2.Cl  
AKOS005214811 235.239 C11 H13 N3 O3 CZTDYVDYKDFWNN-UHFFFAOYSA-N InChI=1S/C11H13N3O3/c15-7-6-12-8-10-11(16)17-13-14(10)9-4-2-1-3-5-9/h1-5,12,15H,6-8H2 c1ccc(cc1)[n+]2c(c(on2)[O-])CNCCO  
AKOS005219453 235.239 C11 H13 N3 O3 LTPGFBFARLZLDU-UHFFFAOYSA-N InChI=1S/C11H13N3O3/c1-12-7-10-11(15)17-13-14(10)8-3-5-9(16-2)6-4-8/h3-6,12H,7H2,1-2H3 CNCc1c(on[n+]1c2ccc(cc2)OC)[O-]  
AKOS005215570 271.7 C11 H13 N3 O3 . Cl H CGUIBIJYOLLPEU-UHFFFAOYSA-N InChI=1S/C11H13N3O3.ClH/c1-12-7-10-11(15)17-13-14(10)8-3-5-9(16-2)6-4-8;/h3-6,12H,7H2,1-2H3;1H CNCc1c(on[n+]1c2ccc(cc2)OC)[O-].Cl  
AKOS005251104 267.304 C11 H13 N3 O3 S VXVWRVQXZKIDDU-UHFFFAOYSA-N InChI=1S/C11H13N3O3S/c1-14-10(11(16)17-13-14)9(15)6-18-8-4-2-7(12)3-5-8/h2,4H,3,5-6,12H2,1H3 C[n+]1c(c(on1)[O-])C(=O)CSC2=CC=C(CC2)N  
AKOS005252436 267.304 C11 H13 N3 O3 S SPISJYBBENXUKE-UHFFFAOYSA-N InChI=1S/C11H13N3O3S/c1-2-14-6-11(17-13-14)12-10(15)8-18-7-9-4-3-5-16-9/h3-6H,2,7-8H2,1H3 CC[n+]1cc(on1)[N-]C(=O)CSCc2ccco2  
AKOS005252638 279.318 C11 H13 N5 O2 S IGACIRIHAOESLN-UHFFFAOYSA-N InChI=1S/C11H13N5O2S/c1-7-4-8(2)13-11(12-7)19-6-9(17)14-10-5-16(3)15-18-10/h4-5H,6H2,1-3H3 Cc1cc(nc(n1)SCC(=O)[N-]c2c[n+](no2)C)C  
AKOS005252762 279.318 C11 H13 N5 O2 S VQVDSOWXJVGILN-UHFFFAOYSA-N InChI=1S/C11H13N5O2S/c1-15(2)16-7-10(18-14-16)13-9(17)8-19-11-5-3-4-6-12-11/h3-7H,8H2,1-2H3 CN(C)[n+]1cc(on1)[N-]C(=O)CSc2ccccn2  
AKOS005252840 279.318 C11 H13 N5 O2 S DIDYUGRNYXFGTG-UHFFFAOYSA-N InChI=1S/C11H13N5O2S/c1-8(2)16-6-10(18-15-16)14-9(17)7-19-11-12-4-3-5-13-11/h3-6,8H,7H2,1-2H3 CC(C)[n+]1cc(on1)[N-]C(=O)CSc2ncccn2  
AKOS005253418 295.318 C11 H13 N5 O3 S WEHIHXNHIOZGHT-UHFFFAOYSA-N InChI=1S/C11H13N5O3S/c1-18-6-5-16-7-10(19-15-16)14-9(17)8-20-11-12-3-2-4-13-11/h2-4,7H,5-6,8H2,1H3 COCC[n+]1cc(on1)[N-]C(=O)CSc2ncccn2  
AKOS005252857 311.317 C11 H13 N5 O4 S LUTZZAUMJCVYQV-UHFFFAOYSA-N InChI=1S/C11H13N5O4S/c1-6(2)16-4-10(20-15-16)12-9(19)5-21-11-13-7(17)3-8(18)14-11/h3-4,6H,5H2,1-2H3,(H2-,12,13,14,15,17,18,19) CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)O)O  
AKOS005253289 327.316 C11 H13 N5 O5 S YOEXZIBILDJSQA-UHFFFAOYSA-N InChI=1S/C11H13N5O5S/c1-20-3-2-16-5-10(21-15-16)12-9(19)6-22-11-13-7(17)4-8(18)14-11/h4-5H,2-3,6H2,1H3,(H2-,12,13,14,15,17,18,19) COCC[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)O)O  
AKOS005215635 357.016 C11 H14 N2 O2 S Sn CRZONVDPRQUNKE-UHFFFAOYSA-N InChI=1S/C8H5N2O2S.3CH3.Sn/c11-8-7(13)10(9-12-8)6-4-2-1-3-5-6;;;;/h1-5H;3*1H3;/q-1;;;;+1 C[Sn](C)(C)Sc1c(on[n+]1c2ccccc2)[O-] MFCD09881666
AKOS001582847 204.248 C11 H14 N3 O UDUSHLMWUKFPIU-UHFFFAOYSA-N InChI=1S/C11H14N3O/c1-9(14-8-11(12)15-13-14)7-10-5-3-2-4-6-10/h2-6,8-9H,7,12H2,1H3/q+1 CC(Cc1ccccc1)[n+]2cc(on2)N  
AKOS005215554 255.701 C11 H14 N3 O2 . Cl IHNNLYOLUYGGBO-UHFFFAOYSA-M InChI=1S/C11H14N3O2.ClH/c1-15-10-5-3-2-4-9(10)6-7-14-8-11(12)16-13-14;/h2-5,8H,6-7,12H2,1H3;1H/q+1;/p-1 COc1ccccc1CC[n+]2cc(on2)N.[Cl-]  
AKOS005252469 266.319 C11 H14 N4 O2 S CKMNSPGJARZMJM-UHFFFAOYSA-N InChI=1S/C11H14N4O2S/c1-15-6-11(17-14-15)13-10(16)7-18-9-4-2-8(12)3-5-9/h2,4,6H,3,5,7,12H2,1H3 C[n+]1cc(on1)[N-]C(=O)CSC2=CC=C(CC2)N  
AKOS005252680 282.319 C11 H14 N4 O3 S CCXRVDOHYBUVEN-UHFFFAOYSA-N InChI=1S/C11H14N4O3S/c1-14(2)15-6-11(18-13-15)12-10(16)8-19-7-9-4-3-5-17-9/h3-6H,7-8H2,1-2H3 CN(C)[n+]1cc(on1)[N-]C(=O)CSCc2ccco2  
AKOS005253040 342.397 C11 H14 N6 O3 S2 DYOSKEOGEGHRHE-UHFFFAOYSA-N InChI=1S/C11H14N6O3S2/c1-8-13-14-11(22-8)21-7-9(18)12-10-6-17(15-20-10)16-2-4-19-5-3-16/h6H,2-5,7H2,1H3 Cc1nnc(s1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3  
AKOS005253030 338.346 C11 H14 N8 O3 S HWPLTQHNXSCRGH-UHFFFAOYSA-N InChI=1S/C11H14N8O3S/c12-10-13-7-14-11(16-10)23-6-8(20)15-9-5-19(17-22-9)18-1-3-21-4-2-18/h5,7H,1-4,6H2,(H2-,12,13,14,15,16,17,20) c1c(on[n+]1N2CCOCC2)[N-]C(=O)CSc3ncnc(n3)N  
AKOS005214232 253.321 C11 H15 N3 O2 S RLVMPJMFLXGRDI-UHFFFAOYSA-N InChI=1S/C11H15N3O2S/c1-8(2)14-10(11(15)16-13-14)7-12-6-9-4-3-5-17-9/h3-5,8,12H,6-7H2,1-2H3 CC(C)[n+]1c(c(on1)[O-])CNCc2cccs2  
AKOS005214209 237.255 C11 H15 N3 O3 QLGNKUNUJPQGRW-UHFFFAOYSA-N InChI=1S/C11H15N3O3/c1-8(2)14-10(11(15)17-13-14)7-12-6-9-4-3-5-16-9/h3-5,8,12H,6-7H2,1-2H3 CC(C)[n+]1c(c(on1)[O-])CNCc2ccco2  
AKOS005215666 237.255 C11 H15 N3 O3 MCJCLBXOGBVDIR-UHFFFAOYSA-N InChI=1S/C11H15N3O3/c1-8(16)12-11-10(7-15)14(13-17-11)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3 CC(=O)[N-]c1c([n+](no1)C2CCCCC2)C=O  
AKOS005251341 301.385 C11 H15 N3 O3 S2 ADBCQSMSKGQVOQ-UHFFFAOYSA-N InChI=1S/C11H15N3O3S2/c1-13-9(10(16)17-12-13)8(15)7-19-11(18)14-5-3-2-4-6-14/h2-7H2,1H3 C[n+]1c(c(on1)[O-])C(=O)CSC(=S)N2CCCCC2  
AKOS005219556 281.334 C11 H15 N5 O2 S AFJUQFUZMYVJEA-UHFFFAOYSA-N InChI=1S/C11H15N5O2S/c1-8(2)16-6-10(18-14-16)13-9(17)7-19-11-12-4-5-15(11)3/h4-6,8H,7H2,1-3H3 CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nccn2C  
AKOS005253411 297.334 C11 H15 N5 O3 S GKPJZELZLICVSU-UHFFFAOYSA-N InChI=1S/C11H15N5O3S/c1-15-4-3-12-11(15)20-8-9(17)13-10-7-16(14-19-10)5-6-18-2/h3-4,7H,5-6,8H2,1-2H3 Cn1ccnc1SCC(=O)[N-]c2c[n+](no2)CCOC  
AKOS005253039 329.398 C11 H15 N5 O3 S2 IJNZKSGHZLWCLE-UHFFFAOYSA-N InChI=1S/C11H15N5O3S2/c17-9(8-21-11-12-1-6-20-11)13-10-7-16(14-19-10)15-2-4-18-5-3-15/h7H,1-6,8H2 c1c(on[n+]1N2CCOCC2)[N-]C(=O)CSC3=NCCS3  
AKOS005252850 309.348 C11 H15 N7 O2 S DUOXIHFRPIQFMX-UHFFFAOYSA-N InChI=1S/C11H15N7O2S/c1-6(2)18-4-10(20-17-18)16-9(19)5-21-11-14-7(12)3-8(13)15-11/h3-4,6H,5H2,1-2H3,(H4-,12,13,14,15,16,17,19) CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)N)N  
AKOS005253142 341.412 C11 H15 N7 O2 S2 LLGKAXFROGPFKK-UHFFFAOYSA-N InChI=1S/C11H15N7O2S2/c12-10-14-15-11(22-10)21-7-8(19)13-9-6-18(16-20-9)17-4-2-1-3-5-17/h6H,1-5,7H2,(H2-,12,13,14,16,19) c1c(on[n+]1N2CCCCC2)[N-]C(=O)CSc3nnc(s3)N  
AKOS005253288 325.347 C11 H15 N7 O3 S NQGCTWNYQHQJLR-UHFFFAOYSA-N InChI=1S/C11H15N7O3S/c1-20-3-2-18-5-10(21-17-18)16-9(19)6-22-11-14-7(12)4-8(13)15-11/h4-5H,2-3,6H2,1H3,(H4-,12,13,14,15,16,17,19) COCC[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)N)N  
AKOS005214976 257.717 C11 H16 Cl N3 O2 SGULFFKVIMCMJC-UHFFFAOYSA-N InChI=1S/C11H16ClN3O2/c1-8(16)13-11-10(7-12)15(14-17-11)9-5-3-2-4-6-9/h9H,2-7H2,1H3 CC(=O)[N-]c1c([n+](no1)C2CCCCC2)CCl  
AKOS005215668 257.717 C11 H16 Cl N3 O2 HRFLQFYSDJVTMP-UHFFFAOYSA-N InChI=1S/C11H16ClN3O2/c12-7-10(16)13-11-8-15(14-17-11)9-5-3-1-2-4-6-9/h8-9H,1-7H2 c1c(on[n+]1C2CCCCCC2)[N-]C(=O)CCl  
AKOS005219548 256.321 C11 H16 N2 O3 S PBJLVJCRZPMAMT-UHFFFAOYSA-N InChI=1S/C11H16N2O3S/c1-13-10(11(15)16-12-13)9(14)7-17-8-5-3-2-4-6-8/h8H,2-7H2,1H3 C[n+]1c(c(on1)[O-])C(=O)CSC2CCCCC2  
AKOS005214875 252.27 C11 H16 N4 O3 JJFLFFGYPNOARQ-UHFFFAOYSA-N InChI=1S/C11H16N4O3/c1-8(16)10-11(12-9(2)17)18-13-15(10)14-6-4-3-5-7-14/h3-7H2,1-2H3 CC(=O)c1c(on[n+]1N2CCCCC2)[N-]C(=O)C  
AKOS005215611 252.27 C11 H16 N4 O3 NNMBDKLZBBENLV-UHFFFAOYSA-N InChI=1S/C11H16N4O3/c1-6-11(2,3)12-10(17)14(4)7-8-9(16)18-13-15(8)5/h1H,7H2,2-5H3,(H-,12,13,16,17) CC(C)(C#C)NC(=O)N(C)Cc1c(on[n+]1C)[O-]  
AKOS005215716 268.269 C11 H16 N4 O4 UBBYSGVDQOCHQW-UHFFFAOYSA-N InChI=1S/C11H16N4O4/c1-9(17)12-11-10(8-16)15(13-19-11)3-2-14-4-6-18-7-5-14/h8H,2-7H2,1H3 CC(=O)[N-]c1c([n+](no1)CCN2CCOCC2)C=O  
AKOS005215030 288.731 C11 H17 Cl N4 O3 GHYWBSFHXRFZBB-UHFFFAOYSA-N InChI=1S/C11H17ClN4O3/c1-9(17)13-11-10(8-12)16(14-19-11)3-2-15-4-6-18-7-5-15/h2-8H2,1H3 CC(=O)[N-]c1c([n+](no1)CCN2CCOCC2)CCl  
AKOS005215736 223.272 C11 H17 N3 O2 HLQMJKSGIDEKPV-UHFFFAOYSA-N InChI=1S/C11H17N3O2/c1-9(15)12-11-8-14(13-16-11)10-6-4-2-3-5-7-10/h8,10H,2-7H2,1H3 CC(=O)[N-]c1c[n+](no1)C2CCCCCC2  
AKOS005252639 255.337 C11 H17 N3 O2 S ALSQDSBJPSXGAK-UHFFFAOYSA-N InChI=1S/C11H17N3O2S/c1-14-7-11(16-13-14)12-10(15)8-17-9-5-3-2-4-6-9/h7,9H,2-6,8H2,1H3 C[n+]1cc(on1)[N-]C(=O)CSC2CCCCC2  
AKOS005214925 239.271 C11 H17 N3 O3 GCLZPEDHZOYSSA-UHFFFAOYSA-N InChI=1S/C11H17N3O3/c1-8(16)12-11-10(7-15)14(13-17-11)9-5-3-2-4-6-9/h9,15H,2-7H2,1H3 CC(=O)[N-]c1c([n+](no1)C2CCCCC2)CO  
AKOS005219459 287.335 C11 H17 N3 O4 S SDGFIIZXNKTRCF-UHFFFAOYSA-N InChI=1S/C11H17N3O4S/c1-4-17-11(16)7-19-6-9(15)12-10-5-14(8(2)3)13-18-10/h5,8H,4,6-7H2,1-3H3 CCOC(=O)CSCC(=O)[N-]c1c[n+](no1)C(C)C  
AKOS005219508 271.27 C11 H17 N3 O5 DMFRFCNLRMNHCL-UHFFFAOYSA-N InChI=1S/C11H17N3O5/c1-7(2)14-8(6-15)9(18-13-14)12-19-10(16)17-11(3,4)5/h6-7H,1-5H3 CC(C)[n+]1c(c(on1)[N-]OC(=O)OC(C)(C)C)C=O  
AKOS005215063 238.286 C11 H18 N4 O2 PEECDRVWJKYRRG-UHFFFAOYSA-N InChI=1S/C11H18N4O2/c1-8(16)13-11-10(7-12)15(14-17-11)9-5-3-2-4-6-9/h9H,2-7,12H2,1H3 CC(=O)[N-]c1c([n+](no1)C2CCCCC2)CN  
AKOS005219498 238.286 C11 H18 N4 O2 LVTVAUXRVQHPSY-UHFFFAOYSA-N InChI=1S/C11H18N4O2/c1-9(2)15-8-11(17-13-15)12-10(16)7-14-5-3-4-6-14/h8-9H,3-7H2,1-2H3 CC(C)[n+]1cc(on1)[N-]C(=O)CN2CCCC2  
AKOS005215013 254.286 C11 H18 N4 O3 UWPLWHXGOCDKPY-UHFFFAOYSA-N InChI=1S/C11H18N4O3/c1-8(16)10-11(12-9(2)17)18-13-15(10)14-6-4-3-5-7-14/h8,16H,3-7H2,1-2H3 CC(c1c(on[n+]1N2CCCCC2)[N-]C(=O)C)O  
AKOS005219497 254.286 C11 H18 N4 O3 IYDRAVJRAWPVBC-UHFFFAOYSA-N InChI=1S/C11H18N4O3/c1-9(2)15-8-11(18-13-15)12-10(16)7-14-3-5-17-6-4-14/h8-9H,3-7H2,1-2H3 CC(C)[n+]1cc(on1)[N-]C(=O)CN2CCOCC2  
AKOS005215578 270.285 C11 H18 N4 O4 NQNHIDGOOXJMHR-UHFFFAOYSA-N InChI=1S/C11H18N4O4/c1-11(2,3)18-10(16)12-9-8-15(13-19-9)14-4-6-17-7-5-14/h8H,4-7H2,1-3H3 CC(C)(C)OC(=O)[N-]c1c[n+](no1)N2CCOCC2  
AKOS005215637 270.285 C11 H18 N4 O4 OWVBXBCPFKTDHJ-UHFFFAOYSA-N InChI=1S/C11H18N4O4/c1-9(17)12-11-10(8-16)15(13-19-11)3-2-14-4-6-18-7-5-14/h16H,2-8H2,1H3 CC(=O)[N-]c1c([n+](no1)CCN2CCOCC2)CO  
AKOS005219478 286.284 C11 H18 N4 O5 LJQSBRQRNFTDDT-UHFFFAOYSA-N InChI=1S/C11H18N4O5/c1-11(2,3)18-10(16)20-12-9-8-15(13-19-9)14-4-6-17-7-5-14/h8H,4-7H2,1-3H3 CC(C)(C)OC(=O)O[N-]c1c[n+](no1)N2CCOCC2  
AKOS005214177 225.287 C11 H19 N3 O2 GPKFGDOQNRUETD-UHFFFAOYSA-N InChI=1S/C11H19N3O2/c1-8(2)14-10(11(15)16-13-14)7-12-9-5-3-4-6-9/h8-9,12H,3-7H2,1-2H3 CC(C)[n+]1c(c(on1)[O-])CNC2CCCC2  
AKOS005214241 225.287 C11 H19 N3 O2 OTROAPKTWOSQCB-UHFFFAOYSA-N InChI=1S/C11H19N3O2/c1-14-10(11(15)16-13-14)8-12-9-6-4-2-3-5-7-9/h9,12H,2-8H2,1H3 C[n+]1c(c(on1)[O-])CNC2CCCCCC2  
AKOS005214231 241.287 C11 H19 N3 O3 LQFLWPQYDVULQW-UHFFFAOYSA-N InChI=1S/C11H19N3O3/c1-8(2)14-10(11(15)17-13-14)7-12-6-9-4-3-5-16-9/h8-9,12H,3-7H2,1-2H3 CC(C)[n+]1c(c(on1)[O-])CNCC2CCCO2  
AKOS005250248 241.287 C11 H19 N3 O3 KVRHNEIMZUPYBI-UHFFFAOYSA-N InChI=1S/C11H19N3O3/c1-11(2,3)6-9(15)13(4)7-8-10(16)17-12-14(8)5/h6-7H2,1-5H3 CC(C)(C)CC(=O)N(C)Cc1c(on[n+]1C)[O-]  
AKOS005214932 253.301 C11 H19 N5 O2 NJDGZTHGQIVEOM-UHFFFAOYSA-N InChI=1S/C11H19N5O2/c1-9(17)13-11-10(8-12-2)16(14-18-11)15-6-4-3-5-7-15/h12H,3-8H2,1-2H3 CC(=O)[N-]c1c([n+](no1)N2CCCCC2)CNC  
AKOS005214892 269.3 C11 H19 N5 O3 FPCALMRTCUDQKF-UHFFFAOYSA-N InChI=1S/C11H19N5O3/c1-9(17)13-11-10(8-12)16(14-19-11)3-2-15-4-6-18-7-5-15/h2-8,12H2,1H3 CC(=O)[N-]c1c([n+](no1)CCN2CCOCC2)CN  
AKOS005214304 240.302 C11 H20 N4 O2 VTFIVHNMSKMSKR-UHFFFAOYSA-N InChI=1S/C11H20N4O2/c1-9(2)15-10(11(16)17-13-15)8-12-14-6-4-3-5-7-14/h9,12H,3-8H2,1-2H3 CC(C)[n+]1c(c(on1)[O-])CNN2CCCCC2  
AKOS005219496 240.302 C11 H20 N4 O2 CEWKTMSSEXYQQO-UHFFFAOYSA-N InChI=1S/C11H20N4O2/c1-5-14(6-2)7-10(16)12-11-8-15(9(3)4)13-17-11/h8-9H,5-7H2,1-4H3 CCN(CC)CC(=O)[N-]c1c[n+](no1)C(C)C  
AKOS005215701 244.27 C11 H21 N2 O2 P LNELCCKXZQRZOQ-UHFFFAOYSA-N InChI=1S/C11H21N2O2P/c1-4-6-8-16(9-7-5-2)10-11(14)15-12-13(10)3/h4-9H2,1-3H3 CCCCP(CCCC)c1c(on[n+]1C)[O-]  
AKOS005214255 227.303 C11 H21 N3 O2 YFIZPYLFQOJSKG-UHFFFAOYSA-N InChI=1S/C11H21N3O2/c1-6-11(4,5)12-7-9-10(15)16-13-14(9)8(2)3/h8,12H,6-7H2,1-5H3 CCC(C)(C)NCc1c(on[n+]1C(C)C)[O-]  
AKOS005214207 243.303 C11 H21 N3 O3 JDTKIUWFTYSGSM-UHFFFAOYSA-N InChI=1S/C11H21N3O3/c1-4-16-7-5-6-12-8-10-11(15)17-13-14(10)9(2)3/h9,12H,4-8H2,1-3H3 CCOCCCNCc1c(on[n+]1C(C)C)[O-]  
AKOS005214315 242.318 C11 H22 N4 O2 JEVMZHSPLUVCLS-UHFFFAOYSA-N InChI=1S/C11H22N4O2/c1-9(2)15-10(11(16)17-13-15)8-12-6-5-7-14(3)4/h9,12H,5-8H2,1-4H3 CC(C)[n+]1c(c(on1)[O-])CNCCCN(C)C  
AKOS005250550 359.157 C11 H4 F7 N3 O3 SUBDSPVFPSVUBX-UHFFFAOYSA-N InChI=1S/C11H4F7N3O3/c1-21-8(10(23)24-20-21)9(22)19-7-5(14)3(12)2(11(16,17)18)4(13)6(7)15/h1H3,(H-,19,20,22,23) C[n+]1c(c(on1)[O-])C(=O)Nc2c(c(c(c(c2F)F)C(F)(F)F)F)F  
AKOS005250511 321.64 C11 H7 Cl F3 N3 O3 XTZOWBVGKOCUDC-UHFFFAOYSA-N InChI=1S/C11H7ClF3N3O3/c1-18-8(10(20)21-17-18)9(19)16-7-3-2-5(12)4-6(7)11(13,14)15/h2-4H,1H3,(H-,16,17,19,20) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2C(F)(F)F)Cl  
AKOS005250512 321.64 C11 H7 Cl F3 N3 O3 DUJYMMGOFARUSO-UHFFFAOYSA-N InChI=1S/C11H7ClF3N3O3/c1-18-8(10(20)21-17-18)9(19)16-7-4-5(11(13,14)15)2-3-6(7)12/h2-4H,1H3,(H-,16,17,19,20) C[n+]1c(c(on1)[O-])C(=O)Nc2cc(ccc2Cl)C(F)(F)F  
AKOS005251116 337.25 C11 H7 F4 N3 O3 S JKBMNAZAZVSVEA-UHFFFAOYSA-N InChI=1S/C11H7F4N3O3S/c1-18-10(11(20)21-17-18)22-3-6(19)16-9-7(14)4(12)2-5(13)8(9)15/h2H,3H2,1H3,(H-,16,17,19,20) C[n+]1c(c(on1)[O-])SCC(=O)Nc2c(c(cc(c2F)F)F)F  
AKOS005252634 277.322 C11 H7 N3 O2 S2 NYECWFDLLBLWJO-UHFFFAOYSA-N InChI=1S/C11H7N3O2S2/c15-10-9(8-6-18-11(17)12-8)14(13-16-10)7-4-2-1-3-5-7/h1-6H,(H-,12,13,15,17) c1ccc(cc1)[n+]2c(c(on2)[O-])c3csc(n3)S  
AKOS005250538 297.651 C11 H8 Cl N3 O5 ISUGDVIVSZUGGS-UHFFFAOYSA-N InChI=1S/C11H8ClN3O5/c1-15-8(11(19)20-14-15)9(16)13-5-2-3-7(12)6(4-5)10(17)18/h2-4H,1H3,(H2-,13,14,16,17,18,19) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c(c2)C(=O)O)Cl  
AKOS005250539 297.651 C11 H8 Cl N3 O5 FVERNOCBKYKYPJ-UHFFFAOYSA-N InChI=1S/C11H8ClN3O5/c1-15-8(11(19)20-14-15)9(16)13-7-4-5(10(17)18)2-3-6(7)12/h2-4H,1H3,(H2-,13,14,16,17,18,19) C[n+]1c(c(on1)[O-])C(=O)Nc2cc(ccc2Cl)C(=O)O  
AKOS005215671 320.559 C11 H8 Cl3 N3 O2 GOAJZPSRSWEGFL-UHFFFAOYSA-N InChI=1S/C11H8Cl3N3O2/c12-4-10(18)15-11-6-17(16-19-11)5-7-1-2-8(13)3-9(7)14/h1-3,6H,4-5H2 c1cc(c(cc1Cl)Cl)C[n+]2cc(on2)[N-]C(=O)CCl  
AKOS000489705 271.195 C11 H8 F3 N3 O2 NLFRPZDXLZBAIP-UHFFFAOYSA-N InChI=1S/C11H8F3N3O2/c1-17-8(7-5-3-2-4-6-7)9(19-16-17)15-10(18)11(12,13)14/h2-6H,1H3 C[n+]1c(c(on1)[N-]C(=O)C(F)(F)F)c2ccccc2 MFCD02655586
AKOS005250506 287.195 C11 H8 F3 N3 O3 JHLSEZLETWXYNU-UHFFFAOYSA-N InChI=1S/C11H8F3N3O3/c1-17-8(10(19)20-16-17)9(18)15-7-5-3-2-4-6(7)11(12,13)14/h2-5H,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2C(F)(F)F  
AKOS005250507 287.195 C11 H8 F3 N3 O3 CJVDKZRWDQHECL-UHFFFAOYSA-N InChI=1S/C11H8F3N3O3/c1-17-8(10(19)20-16-17)9(18)15-7-4-2-3-6(5-7)11(12,13)14/h2-5H,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])C(=O)Nc2cccc(c2)C(F)(F)F  
AKOS005250578 303.194 C11 H8 F3 N3 O4 TUNZYXNQRCYYKT-UHFFFAOYSA-N InChI=1S/C11H8F3N3O4/c1-17-8(10(19)21-16-17)9(18)15-6-2-4-7(5-3-6)20-11(12,13)14/h2-5H,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)OC(F)(F)F  
AKOS005250585 303.194 C11 H8 F3 N3 O4 CKQAWPXXCWNWBB-UHFFFAOYSA-N InChI=1S/C11H8F3N3O4/c1-17-8(10(19)21-16-17)9(18)15-6-4-2-3-5-7(6)20-11(12,13)14/h2-5H,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2OC(F)(F)F  
AKOS005215633 232.258 C11 H8 N2 O2 S IZHQQSBUVUUQFA-UHFFFAOYSA-N InChI=1S/C11H8N2O2S/c1-2-8-16-10-11(14)15-12-13(10)9-6-4-3-5-7-9/h1,3-7H,8H2 C#CCSc1c(on[n+]1c2ccccc2)[O-] MFCD09881665
AKOS005252633 296.733 C11 H8 N4 O2 S . Cl H HVCFXRDUZYWDEV-UHFFFAOYSA-N InChI=1S/C11H8N4O2S.ClH/c12-11-13-8(6-18-11)9-10(16)17-14-15(9)7-4-2-1-3-5-7;/h1-6H,(H2-,12,13,14,16);1H c1ccc(cc1)[n+]2c(c(on2)[O-])c3csc(n3)N.Cl  
AKOS005251325 362.175 C11 H9 Br F N3 O3 S ZPAZRVQPDWXYKV-UHFFFAOYSA-N InChI=1S/C11H9BrFN3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-8-3-2-6(12)4-7(8)13/h2-4H,5H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2F)Br  
AKOS005215681 269.659 C11 H9 Cl F N3 O2 OXRXKXXTANTUTH-UHFFFAOYSA-N InChI=1S/C11H9ClFN3O2/c12-5-10(17)14-11-7-16(15-18-11)6-8-1-3-9(13)4-2-8/h1-4,7H,5-6H2 c1cc(ccc1C[n+]2cc(on2)[N-]C(=O)CCl)F  
AKOS005251307 317.724 C11 H9 Cl F N3 O3 S RZYZRBLMPFISKJ-UHFFFAOYSA-N InChI=1S/C11H9ClFN3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-6-2-3-8(13)7(12)4-6/h2-4H,5H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c(c2)Cl)F  
AKOS005219549 284.719 C11 H9 Cl N2 O3 S ANWNRRMIBXLFQA-UHFFFAOYSA-N InChI=1S/C11H9ClN2O3S/c1-14-10(11(16)17-13-14)9(15)6-18-8-4-2-7(12)3-5-8/h2-5H,6H2,1H3 C[n+]1c(c(on1)[O-])C(=O)CSc2ccc(cc2)Cl  
AKOS005215541 286.114 C11 H9 Cl2 N3 O2 CXZYNDKBLNZTBM-UHFFFAOYSA-N InChI=1S/C11H9Cl2N3O2/c1-7(17)14-11-6-16(15-18-11)5-8-2-3-9(12)4-10(8)13/h2-4,6H,5H2,1H3 CC(=O)[N-]c1c[n+](no1)Cc2ccc(cc2Cl)Cl  
AKOS005215694 286.114 C11 H9 Cl2 N3 O2 SDZVFOIJPCTGNL-UHFFFAOYSA-N InChI=1S/C11H9Cl2N3O2/c12-5-10(17)14-11-7-16(15-18-11)6-8-3-1-2-4-9(8)13/h1-4,7H,5-6H2 c1ccc(c(c1)C[n+]2cc(on2)[N-]C(=O)CCl)Cl  
AKOS005251289 334.178 C11 H9 Cl2 N3 O3 S CIASDLKZHFVZGU-UHFFFAOYSA-N InChI=1S/C11H9Cl2N3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-8-4-6(12)2-3-7(8)13/h2-4H,5H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCC(=O)Nc2cc(ccc2Cl)Cl  
AKOS005251290 334.178 C11 H9 Cl2 N3 O3 S DPGALQNOPALARC-UHFFFAOYSA-N InChI=1S/C11H9Cl2N3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-6-2-3-7(12)8(13)4-6/h2-4H,5H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c(c2)Cl)Cl  
AKOS005251291 334.178 C11 H9 Cl2 N3 O3 S NVURYWQOQZYXMG-UHFFFAOYSA-N InChI=1S/C11H9Cl2N3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-8-3-6(12)2-7(13)4-8/h2-4H,5H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCC(=O)Nc2cc(cc(c2)Cl)Cl  
AKOS005251334 334.178 C11 H9 Cl2 N3 O3 S XFGMVVMYSJBGHC-UHFFFAOYSA-N InChI=1S/C11H9Cl2N3O3S/c1-16-10(11(18)19-15-16)20-5-8(17)14-7-4-2-3-6(12)9(7)13/h2-4H,5H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCC(=O)Nc2cccc(c2Cl)Cl  
AKOS005251335 334.178 C11 H9 Cl2 N3 O3 S LIAIGYXRVDWCEQ-UHFFFAOYSA-N InChI=1S/C11H9Cl2N3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-8-3-2-6(12)4-7(8)13/h2-4H,5H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2Cl)Cl  
AKOS005251130 301.269 C11 H9 F2 N3 O3 S BLLWBIXIDHYCRN-UHFFFAOYSA-N InChI=1S/C11H9F2N3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-6-2-3-7(12)8(13)4-6/h2-4H,5H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c(c2)F)F  
AKOS005215518 231.207 C11 H9 N3 O3 QCZIKYAZOTYUQH-UHFFFAOYSA-N InChI=1S/C11H9N3O3/c1-14-9(7-15)11(17-13-14)12-10(16)8-5-3-2-4-6-8/h2-7H,1H3 C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C=O  
AKOS005251274 263.272 C11 H9 N3 O3 S XFZBFBQBUNMXRS-UHFFFAOYSA-N InChI=1S/C11H9N3O3S/c1-16-9-4-2-8(3-5-9)14-10(18-7-6-12)11(15)17-13-14/h2-5H,7H2,1H3 COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC#N  
AKOS005250540 263.206 C11 H9 N3 O5 SZNJFJBZXLMZIU-UHFFFAOYSA-N InChI=1S/C11H9N3O5/c1-14-8(11(18)19-13-14)9(15)12-7-4-2-6(3-5-7)10(16)17/h2-5H,1H3,(H2-,12,13,15,16,17,18) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)C(=O)O  
AKOS005250541 263.206 C11 H9 N3 O5 XVLJVZRJXWLMHH-UHFFFAOYSA-N InChI=1S/C11H9N3O5/c1-14-8(11(18)19-13-14)9(15)12-7-4-2-3-6(5-7)10(16)17/h2-5H,1H3,(H2-,12,13,15,16,17,18) C[n+]1c(c(on1)[O-])C(=O)Nc2cccc(c2)C(=O)O  
AKOS005250577 263.206 C11 H9 N3 O5 HMFUTARHKKVAHS-UHFFFAOYSA-N InChI=1S/C11H9N3O5/c1-14-9(11(16)19-13-14)10(15)12-6-2-3-7-8(4-6)18-5-17-7/h2-4H,5H2,1H3,(H-,12,13,15,16) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc3c(c2)OCO3  
AKOS005250567 279.206 C11 H9 N3 O6 JCQTUDMLEMNBPD-UHFFFAOYSA-N InChI=1S/C11H9N3O6/c1-14-8(11(19)20-13-14)9(16)12-5-2-3-7(15)6(4-5)10(17)18/h2-4,13H,1H3,(H2,16,17,18,19) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c(c2)C(=O)O)O  
AKOS005251231 309.278 C11 H9 N4 O5 S YPZPEZKUYUIRDH-UHFFFAOYSA-M InChI=1S/C11H10N4O5S/c1-14-10(11(17)20-13-14)21-6-9(16)12-7-2-4-8(5-3-7)15(18)19/h2,4-5,17H,6H2,1H3,(H,12,16)/p-1 C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c[c-]2)[N+](=O)[O-]  
AKOS005215692 279.679 C12 H10 Cl N3 O3 SKSJDBIMSHYAOD-UHFFFAOYSA-N InChI=1S/C12H10ClN3O3/c1-8(18)14-12-11(7-17)16(15-19-12)6-9-4-2-3-5-10(9)13/h2-5,7H,6H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccccc2Cl)C=O  
AKOS005251226 343.743 C12 H10 Cl N3 O5 S KCVVVJBJQHGTKR-UHFFFAOYSA-N InChI=1S/C12H10ClN3O5S/c1-16-10(12(20)21-15-16)22-5-9(17)14-6-2-3-8(13)7(4-6)11(18)19/h2-4H,5H2,1H3,(H2-,14,15,17,18,19,20) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c(c2)C(=O)O)Cl  
AKOS005251227 343.743 C12 H10 Cl N3 O5 S YXRPWNXFZFZDII-UHFFFAOYSA-N InChI=1S/C12H10ClN3O5S/c1-16-10(12(20)21-15-16)22-5-9(17)14-8-4-6(11(18)19)2-3-7(8)13/h2-4H,5H2,1H3,(H2-,14,15,17,18,19,20) C[n+]1c(c(on1)[O-])SCC(=O)Nc2cc(ccc2Cl)C(=O)O  
AKOS005214988 334.586 C12 H10 Cl3 N3 O2 BLIRIQFYVIBXRH-UHFFFAOYSA-N InChI=1S/C12H10Cl3N3O2/c1-7(19)16-12-11(5-13)18(17-20-12)6-8-2-3-9(14)4-10(8)15/h2-4H,5-6H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2Cl)Cl)CCl  
AKOS005215679 263.224 C12 H10 F N3 O3 MZWGAPDBGPCRFB-UHFFFAOYSA-N InChI=1S/C12H10FN3O3/c1-8(18)14-12-11(7-17)16(15-19-12)6-9-2-4-10(13)5-3-9/h2-5,7H,6H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)F)C=O  
AKOS005250263 301.221 C12 H10 F3 N3 O3 DXRCHLINLRWXRJ-UHFFFAOYSA-N InChI=1S/C12H10F3N3O3/c1-17(11(20)12(13,14)15)7-9-10(19)21-16-18(9)8-5-3-2-4-6-8/h2-6H,7H2,1H3 CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)C(F)(F)F  
AKOS005251299 333.286 C12 H10 F3 N3 O3 S HAZKFAZZFNYTTJ-UHFFFAOYSA-N InChI=1S/C12H10F3N3O3S/c1-18-10(11(20)21-17-18)22-6-9(19)16-8-5-3-2-4-7(8)12(13,14)15/h2-5H,6H2,1H3,(H-,16,17,19,20) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2C(F)(F)F  
AKOS005251300 333.286 C12 H10 F3 N3 O3 S XBRRYQRNMCGCIW-UHFFFAOYSA-N InChI=1S/C12H10F3N3O3S/c1-18-10(11(20)21-17-18)22-6-9(19)16-8-4-2-3-7(5-8)12(13,14)15/h2-5H,6H2,1H3,(H-,16,17,19,20) C[n+]1c(c(on1)[O-])SCC(=O)Nc2cccc(c2)C(F)(F)F  
AKOS005251126 349.286 C12 H10 F3 N3 O4 S ACGFOOPCODQEPJ-UHFFFAOYSA-N InChI=1S/C12H10F3N3O4S/c1-18-10(11(20)22-17-18)23-6-9(19)16-7-2-4-8(5-3-7)21-12(13,14)15/h2-5H,6H2,1H3,(H-,16,17,19,20) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)OC(F)(F)F  
AKOS005251127 349.286 C12 H10 F3 N3 O4 S HZWXBKDRXYMLSY-UHFFFAOYSA-N InChI=1S/C12H10F3N3O4S/c1-18-10(11(20)22-17-18)23-6-9(19)16-7-4-2-3-5-8(7)21-12(13,14)15/h2-5H,6H2,1H3,(H-,16,17,19,20) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2OC(F)(F)F  
AKOS005215699 230.219 C12 H10 N2 O3 INNOJSJFEYNWFI-UHFFFAOYSA-N InChI=1S/C12H10N2O3/c15-11(8-6-7-8)10-12(16)17-13-14(10)9-4-2-1-3-5-9/h1-5,8H,6-7H2 c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)C3CC3  
AKOS005215533 262.218 C12 H10 N2 O5 SOBAWFTZHGIDIC-UHFFFAOYSA-N InChI=1S/C12H10N2O5/c1-2-18-12(17)10(15)9-11(16)19-13-14(9)8-6-4-3-5-7-8/h3-7H,2H2,1H3 CCOC(=O)C(=O)c1c(on[n+]1c2ccccc2)[O-] MFCD09881669
AKOS005250587 258.233 C12 H10 N4 O3 CWACSEHIRXQVDU-UHFFFAOYSA-N InChI=1S/C12H10N4O3/c1-16-10(12(18)19-15-16)11(17)14-8-2-3-9-7(6-8)4-5-13-9/h2-6,15H,1H3,(H,17,18) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc3c(c2)cc[nH]3  
AKOS005250681 290.298 C12 H10 N4 O3 S YNESDKZNDDGYGZ-UHFFFAOYSA-N InChI=1S/C12H10N4O3S/c1-16-10(11(18)19-15-16)9(17)6-20-12-13-7-4-2-3-5-8(7)14-12/h2-5H,6H2,1H3,(H-,13,14,15,17,18) C[n+]1c(c(on1)[O-])C(=O)CSc2[nH]c3ccccc3n2  
AKOS005250740 290.298 C12 H10 N4 O3 S UEUVBFPEZRRVTQ-UHFFFAOYSA-N InChI=1S/C12H10N4O3S/c1-7-3-4-8(5-13)11(14-7)20-6-9(17)10-12(18)19-15-16(10)2/h3-4H,6H2,1-2H3 Cc1ccc(c(n1)SCC(=O)c2c(on[n+]2C)[O-])C#N  
AKOS005252591 290.298 C12 H10 N4 O3 S GQANLDJCDCYKBL-UHFFFAOYSA-N InChI=1S/C12H10N4O3S/c1-16-6-11(19-15-16)14-10(17)7-20-12-13-8-4-2-3-5-9(8)18-12/h2-6H,7H2,1H3 C[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3o2  
AKOS005253839 290.298 C12 H10 N4 O3 S LGZGGLBXBZSAJJ-UHFFFAOYSA-N InChI=1S/C12H10N4O3S/c1-5-3-4-6-7(13)10(20-11(6)14-5)9(17)8-12(18)19-15-16(8)2/h3-4H,1-2H3,(H2-,13,15,17,18) Cc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3C)[O-])N  
AKOS005252623 326.759 C12 H10 N4 O3 S . Cl H UQCAZLUAQHMRCI-UHFFFAOYSA-N InChI=1S/C12H10N4O3S.ClH/c1-18-8-4-2-7(3-5-8)16-10(11(17)19-15-16)9-6-20-12(13)14-9;/h2-6H,1H3,(H2-,13,14,15,17);1H COc1ccc(cc1)[n+]2c(c(on2)[O-])c3csc(n3)N.Cl  
AKOS005250687 318.311 C12 H10 N6 O3 S DESIITMYUKANLN-UHFFFAOYSA-N InChI=1S/C12H10N6O3S/c1-17-10(11(20)21-16-17)9(19)7-22-12-13-14-15-18(12)8-5-3-2-4-6-8/h2-6H,7H2,1H3 C[n+]1c(c(on1)[O-])C(=O)CSc2nnnn2c3ccccc3  
AKOS005251397 376.201 C12 H11 Br F N3 O3 S KUWJDMMCCIAIFF-UHFFFAOYSA-N InChI=1S/C12H11BrFN3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-9-4-3-7(13)5-8(9)14/h3-6H,1-2H3,(H-,15,16,18,19) CC(C(=O)Nc1ccc(cc1F)Br)Sc2c(on[n+]2C)[O-]  
AKOS005252287 376.201 C12 H11 Br F N3 O3 S PZWLJFDRGNNJGK-UHFFFAOYSA-N InChI=1S/C12H11BrFN3O3S/c1-17-11(12(19)20-16-17)21-5-4-10(18)15-9-3-2-7(13)6-8(9)14/h2-3,6H,4-5H2,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2F)Br  
AKOS005214989 283.686 C12 H11 Cl F N3 O2 NYZDEHGPMKHIIX-UHFFFAOYSA-N InChI=1S/C12H11ClFN3O2/c1-8(18)15-12-11(6-13)17(16-19-12)7-9-2-4-10(14)5-3-9/h2-5H,6-7H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)F)CCl  
AKOS005251401 331.75 C12 H11 Cl F N3 O3 S AEPYOEQJJBYQTI-UHFFFAOYSA-N InChI=1S/C12H11ClFN3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-7-3-4-9(14)8(13)5-7/h3-6H,1-2H3,(H-,15,16,18,19) CC(C(=O)Nc1ccc(c(c1)Cl)F)Sc2c(on[n+]2C)[O-]  
AKOS005252291 331.75 C12 H11 Cl F N3 O3 S RPBKXIFHTLFGQY-UHFFFAOYSA-N InChI=1S/C12H11ClFN3O3S/c1-17-11(12(19)20-16-17)21-5-4-10(18)15-7-2-3-9(14)8(13)6-7/h2-3,6H,4-5H2,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(c(c2)Cl)F  
AKOS005215003 300.141 C12 H11 Cl2 N3 O2 JHZNAFBKILCAPB-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O2/c1-8(18)15-12-11(6-13)17(16-19-12)7-9-4-2-3-5-10(9)14/h2-5H,6-7H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccccc2Cl)CCl  
AKOS005214938 316.14 C12 H11 Cl2 N3 O3 SEKSFHBZAKRFOQ-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O3/c1-7(19)15-12-11(6-18)17(16-20-12)5-8-2-3-9(13)4-10(8)14/h2-4,18H,5-6H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2Cl)Cl)CO  
AKOS005250374 316.14 C12 H11 Cl2 N3 O3 VPSPTMKGLUXBCN-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O3/c1-16(6-10-12(19)20-15-17(10)2)11(18)8-4-3-7(13)5-9(8)14/h3-5H,6H2,1-2H3 C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccc(cc2Cl)Cl  
AKOS005251405 348.205 C12 H11 Cl2 N3 O3 S MXTWEMLDIIXSFE-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-8-5-3-4-7(13)9(8)14/h3-6H,1-2H3,(H-,15,16,18,19) CC(C(=O)Nc1cccc(c1Cl)Cl)Sc2c(on[n+]2C)[O-]  
AKOS005251406 348.205 C12 H11 Cl2 N3 O3 S VXWHKJDBSJHEAS-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-9-4-3-7(13)5-8(9)14/h3-6H,1-2H3,(H-,15,16,18,19) CC(C(=O)Nc1ccc(cc1Cl)Cl)Sc2c(on[n+]2C)[O-]  
AKOS005251407 348.205 C12 H11 Cl2 N3 O3 S TWYDYEOLRMOOGY-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-9-5-7(13)3-4-8(9)14/h3-6H,1-2H3,(H-,15,16,18,19) CC(C(=O)Nc1cc(ccc1Cl)Cl)Sc2c(on[n+]2C)[O-]  
AKOS005251408 348.205 C12 H11 Cl2 N3 O3 S SLRZRPCHIFCMAG-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-7-3-4-8(13)9(14)5-7/h3-6H,1-2H3,(H-,15,16,18,19) CC(C(=O)Nc1ccc(c(c1)Cl)Cl)Sc2c(on[n+]2C)[O-]  
AKOS005251409 348.205 C12 H11 Cl2 N3 O3 S XAMXLVITUWRWHW-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-9-4-7(13)3-8(14)5-9/h3-6H,1-2H3,(H-,15,16,18,19) CC(C(=O)Nc1cc(cc(c1)Cl)Cl)Sc2c(on[n+]2C)[O-]  
AKOS005252305 348.205 C12 H11 Cl2 N3 O3 S AZMDAABYWIVOPX-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O3S/c1-17-11(12(19)20-16-17)21-6-5-9(18)15-8-4-2-3-7(13)10(8)14/h2-4H,5-6H2,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cccc(c2Cl)Cl  
AKOS005252306 348.205 C12 H11 Cl2 N3 O3 S CZLVAIKOGMBDSI-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O3S/c1-17-11(12(19)20-16-17)21-5-4-10(18)15-9-3-2-7(13)6-8(9)14/h2-3,6H,4-5H2,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2Cl)Cl  
AKOS005252307 348.205 C12 H11 Cl2 N3 O3 S NFMYWFOVRMPJMR-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O3S/c1-17-11(12(19)20-16-17)21-5-4-10(18)15-9-6-7(13)2-3-8(9)14/h2-3,6H,4-5H2,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cc(ccc2Cl)Cl  
AKOS005252315 348.205 C12 H11 Cl2 N3 O3 S NIJQTVLAEXTVGN-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O3S/c1-17-11(12(19)20-16-17)21-5-4-10(18)15-7-2-3-8(13)9(14)6-7/h2-3,6H,4-5H2,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(c(c2)Cl)Cl  
AKOS005252316 348.205 C12 H11 Cl2 N3 O3 S YRQZHBOGBHGMIZ-UHFFFAOYSA-N InChI=1S/C12H11Cl2N3O3S/c1-17-11(12(19)20-16-17)21-3-2-10(18)15-9-5-7(13)4-8(14)6-9/h4-6H,2-3H2,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cc(cc(c2)Cl)Cl  
AKOS005251506 315.296 C12 H11 F2 N3 O3 S WEIYXSGQFWCSHI-UHFFFAOYSA-N InChI=1S/C12H11F2N3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-7-3-4-8(13)9(14)5-7/h3-6H,1-2H3,(H-,15,16,18,19) CC(C(=O)Nc1ccc(c(c1)F)F)Sc2c(on[n+]2C)[O-]  
AKOS005252344 315.296 C12 H11 F2 N3 O3 S FVBXXLAIDSSXCO-UHFFFAOYSA-N InChI=1S/C12H11F2N3O3S/c1-17-11(12(19)20-16-17)21-5-4-10(18)15-7-2-3-8(13)9(14)6-7/h2-3,6H,4-5H2,1H3,(H-,15,16,18,19) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(c(c2)F)F  
AKOS005215492 245.234 C12 H11 N3 O3 ZPDXWFXYORVBHT-UHFFFAOYSA-N InChI=1S/C12H11N3O3/c1-2-15-10(8-16)12(18-14-15)13-11(17)9-6-4-3-5-7-9/h3-8H,2H2,1H3 CC[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C=O  
AKOS005215667 245.234 C12 H11 N3 O3 KWCIUPLOHVYZDI-UHFFFAOYSA-N InChI=1S/C12H11N3O3/c1-9(17)13-12-11(8-16)15(14-18-12)7-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccccc2)C=O  
AKOS005250516 261.233 C12 H11 N3 O4 HMYBDABAJIGKKP-UHFFFAOYSA-N InChI=1S/C12H11N3O4/c1-7(16)8-3-5-9(6-4-8)13-11(17)10-12(18)19-14-15(10)2/h3-6H,1-2H3,(H-,13,14,16,17,18) CC(=O)c1ccc(cc1)NC(=O)c2c(on[n+]2C)[O-]  
AKOS005219767 293.298 C12 H11 N3 O4 S RJXYDYCEFHNKDI-UHFFFAOYSA-N InChI=1S/C12H11N3O4S/c16-11(17)8-6-13-10(20-8)9-12(18)19-14-15(9)7-4-2-1-3-5-7/h1-5,8,10,13H,6H2,(H-,14,16,17,18) c1ccc(cc1)[n+]2c(c(on2)[O-])C3NCC(S3)C(=O)O  
AKOS005250531 277.233 C12 H11 N3 O5 LGFKPKQEQGMGHZ-UHFFFAOYSA-N InChI=1S/C12H11N3O5/c1-15-9(12(18)20-14-15)10(16)13-8-6-4-3-5-7(8)11(17)19-2/h3-6H,1-2H3,(H-,13,14,16,17,18) C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2C(=O)OC  
AKOS005250559 277.233 C12 H11 N3 O5 TZQYYCUHIGUHLU-UHFFFAOYSA-N InChI=1S/C12H11N3O5/c1-6-3-4-7(11(17)18)5-8(6)13-10(16)9-12(19)20-14-15(9)2/h3-5H,1-2H3,(H2-,13,14,16,17,18,19) Cc1ccc(cc1NC(=O)c2c(on[n+]2C)[O-])C(=O)O  
AKOS005250576 277.233 C12 H11 N3 O5 OTWIHDGRXNFEAA-UHFFFAOYSA-N InChI=1S/C12H11N3O5/c1-15-10(12(17)20-14-15)11(16)13-7-2-3-8-9(6-7)19-5-4-18-8/h2-3,6H,4-5H2,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc3c(c2)OCCO3  
AKOS005251125 309.298 C12 H11 N3 O5 S CQVLVPRVDCYALE-UHFFFAOYSA-N InChI=1S/C12H11N3O5S/c1-15-11(12(17)20-14-15)21-5-10(16)13-7-2-3-8-9(4-7)19-6-18-8/h2-4H,5-6H2,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc3c(c2)OCO3  
AKOS005251228 309.298 C12 H11 N3 O5 S ABQQMWSPKVHPNM-UHFFFAOYSA-N InChI=1S/C12H11N3O5S/c1-15-10(12(19)20-14-15)21-6-9(16)13-8-4-2-7(3-5-8)11(17)18/h2-5H,6H2,1H3,(H2-,13,14,16,17,18,19) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)C(=O)O  
AKOS005251238 309.298 C12 H11 N3 O5 S GTJSEFSHZBBTKS-UHFFFAOYSA-N InChI=1S/C12H11N3O5S/c1-15-10(12(19)20-14-15)21-6-9(16)13-8-4-2-3-7(5-8)11(17)18/h2-5H,6H2,1H3,(H2-,13,14,16,17,18,19) C[n+]1c(c(on1)[O-])SCC(=O)Nc2cccc(c2)C(=O)O  
AKOS005250596 293.232 C12 H11 N3 O6 VZNJLIPWWHMOFF-UHFFFAOYSA-N InChI=1S/C12H11N3O6/c1-15-9(12(19)21-14-15)10(16)13-7-4-3-6(11(17)18)5-8(7)20-2/h3-5H,1-2H3,(H2-,13,14,16,17,18,19) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2OC)C(=O)O  
AKOS005251121 325.297 C12 H11 N3 O6 S UDYBJEVRPWOEFK-UHFFFAOYSA-N InChI=1S/C12H11N3O6S/c1-15-10(12(20)21-14-15)22-5-9(17)13-6-2-3-8(16)7(4-6)11(18)19/h2-4,14H,5H2,1H3,(H2,18,19,20) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c(c2)C(=O)O)O  
AKOS005251424 323.305 C12 H11 N4 O5 S FWVUQOLCVLIFDP-UHFFFAOYSA-M InChI=1S/C12H12N4O5S/c1-7(22-11-12(18)21-14-15(11)2)10(17)13-8-3-5-9(6-4-8)16(19)20/h3,5-7,18H,1-2H3,(H,13,17)/p-1 CC(C(=O)Nc1ccc(c[c-]1)[N+](=O)[O-])Sc2c(on[n+]2C)[O-]  
AKOS005252338 323.305 C12 H11 N4 O5 S SWYGCRYFLREXAI-UHFFFAOYSA-M InChI=1S/C12H12N4O5S/c1-15-11(12(18)21-14-15)22-7-6-10(17)13-8-2-4-9(5-3-8)16(19)20/h2,4-5,18H,6-7H2,1H3,(H,13,17)/p-1 C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(c[c-]2)[N+](=O)[O-]  
AKOS005252533 289.313 C12 H11 N5 O2 S JMNOIAXFUAFSGG-UHFFFAOYSA-N InChI=1S/C12H11N5O2S/c1-8-3-4-9(5-13)12(14-8)20-7-10(18)15-11-6-17(2)16-19-11/h3-4,6H,7H2,1-2H3 Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)C)C#N  
AKOS005252609 289.313 C12 H11 N5 O2 S JCEWWRRPHFJALV-UHFFFAOYSA-N InChI=1S/C12H11N5O2S/c1-17-6-11(19-16-17)15-10(18)7-20-12-13-8-4-2-3-5-9(8)14-12/h2-6H,7H2,1H3,(H-,13,14,15,16,18) C[n+]1cc(on1)[N-]C(=O)CSc2[nH]c3ccccc3n2  
AKOS005252602 317.326 C12 H11 N7 O2 S HEAKGWYZKHICIX-UHFFFAOYSA-N InChI=1S/C12H11N7O2S/c1-18-7-11(21-17-18)13-10(20)8-22-12-14-15-16-19(12)9-5-3-2-4-6-9/h2-7H,8H2,1H3 C[n+]1cc(on1)[N-]C(=O)CSc2nnnn2c3ccccc3  
AKOS005215529 342.212 C12 H12 Br N3 O2 S RPPFATPLTFJHSB-AATRIKPKSA-N InChI=1S/C12H12BrN3O2S/c1-8(2)16-11(13)12(18-15-16)14-10(17)6-5-9-4-3-7-19-9/h3-8H,1-2H3/b6-5+ CC(C)[n+]1c(c(on1)[N-]C(=O)/C=C/c2cccs2)Br  
AKOS005251395 358.211 C12 H12 Br N3 O3 S UEPCGMBIWLBTPP-UHFFFAOYSA-N InChI=1S/C12H12BrN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-6-4-3-5-8(9)13/h3-7H,1-2H3,(H-,14,15,17,18) CC(C(=O)Nc1ccccc1Br)Sc2c(on[n+]2C)[O-]  
AKOS005251396 358.211 C12 H12 Br N3 O3 S QLWLFAUZOLSAKG-UHFFFAOYSA-N InChI=1S/C12H12BrN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-5-3-8(13)4-6-9/h3-7H,1-2H3,(H-,14,15,17,18) CC(C(=O)Nc1ccc(cc1)Br)Sc2c(on[n+]2C)[O-]  
AKOS005252284 358.211 C12 H12 Br N3 O3 S PCNUCEKLJIEQMZ-UHFFFAOYSA-N InChI=1S/C12H12BrN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-5-3-2-4-8(9)13/h2-5H,6-7H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2Br  
AKOS005252286 358.211 C12 H12 Br N3 O3 S DPWFNKCCQUNVCG-UHFFFAOYSA-N InChI=1S/C12H12BrN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-4-2-8(13)3-5-9/h2-5H,6-7H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)Br  
AKOS005214977 265.696 C12 H12 Cl N3 O2 LPYWKKOWFVOZET-UHFFFAOYSA-N InChI=1S/C12H12ClN3O2/c1-9(17)14-12-11(7-13)16(15-18-12)8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccccc2)CCl  
AKOS005215682 265.696 C12 H12 Cl N3 O2 VUZXVRCKWRZKAL-UHFFFAOYSA-N InChI=1S/C12H12ClN3O2/c1-9-2-4-10(5-3-9)7-16-8-12(18-15-16)14-11(17)6-13/h2-5,8H,6-7H2,1H3 Cc1ccc(cc1)C[n+]2cc(on2)[N-]C(=O)CCl  
AKOS005215695 265.696 C12 H12 Cl N3 O2 UHLIGCXJWVGCHY-UHFFFAOYSA-N InChI=1S/C12H12ClN3O2/c13-8-11(17)14-12-9-16(15-18-12)7-6-10-4-2-1-3-5-10/h1-5,9H,6-8H2 c1ccc(cc1)CC[n+]2cc(on2)[N-]C(=O)CCl  
AKOS005219467 265.696 C12 H12 Cl N3 O2 WWXBSUWCPDSIRF-UHFFFAOYSA-N InChI=1S/C12H12ClN3O2/c1-8(2)16-10(13)12(18-15-16)14-11(17)9-6-4-3-5-7-9/h3-8H,1-2H3 CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)Cl  
AKOS005252513 297.761 C12 H12 Cl N3 O2 S YETGWKAXJRVCHR-UHFFFAOYSA-N InChI=1S/C12H12ClN3O2S/c1-2-16-7-12(18-15-16)14-11(17)8-19-10-5-3-9(13)4-6-10/h3-7H,2,8H2,1H3 CC[n+]1cc(on1)[N-]C(=O)CSc2ccc(cc2)Cl  
AKOS005214952 281.695 C12 H12 Cl N3 O3 ZCRVYZYWOFOVPF-UHFFFAOYSA-N InChI=1S/C12H12ClN3O3/c1-8(18)14-12-11(7-17)16(15-19-12)6-9-4-2-3-5-10(9)13/h2-5,17H,6-7H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccccc2Cl)CO  
AKOS005215683 281.695 C12 H12 Cl N3 O3 RPCOOGCZCJWKOI-UHFFFAOYSA-N InChI=1S/C12H12ClN3O3/c1-18-10-4-2-9(3-5-10)7-16-8-12(19-15-16)14-11(17)6-13/h2-5,8H,6-7H2,1H3 COc1ccc(cc1)C[n+]2cc(on2)[N-]C(=O)CCl  
AKOS005250354 281.695 C12 H12 Cl N3 O3 OPYQKESSDARRLL-UHFFFAOYSA-N InChI=1S/C12H12ClN3O3/c1-15(7-10-12(18)19-14-16(10)2)11(17)8-4-3-5-9(13)6-8/h3-6H,7H2,1-2H3 C[n+]1c(c(on1)[O-])CN(C)C(=O)c2cccc(c2)Cl  
AKOS005251308 313.76 C12 H12 Cl N3 O3 S WQPAGVSCNWLTQL-UHFFFAOYSA-N InChI=1S/C12H12ClN3O3S/c1-7-8(13)4-3-5-9(7)14-10(17)6-20-11-12(18)19-15-16(11)2/h3-5H,6H2,1-2H3,(H-,14,15,17,18) Cc1c(cccc1Cl)NC(=O)CSc2c(on[n+]2C)[O-]  
AKOS005251309 313.76 C12 H12 Cl N3 O3 S YHMJTXVFCAJUHY-UHFFFAOYSA-N InChI=1S/C12H12ClN3O3S/c1-7-3-4-8(5-9(7)13)14-10(17)6-20-11-12(18)19-15-16(11)2/h3-5H,6H2,1-2H3,(H-,14,15,17,18) Cc1ccc(cc1Cl)NC(=O)CSc2c(on[n+]2C)[O-]  
AKOS005251333 313.76 C12 H12 Cl N3 O3 S ZSMOIZKMQFEOOU-UHFFFAOYSA-N InChI=1S/C12H12ClN3O3S/c1-7-3-4-8(13)5-9(7)14-10(17)6-20-11-12(18)19-15-16(11)2/h3-5H,6H2,1-2H3,(H-,14,15,17,18) Cc1ccc(cc1NC(=O)CSc2c(on[n+]2C)[O-])Cl  
AKOS005251398 313.76 C12 H12 Cl N3 O3 S GHJFUCWJJJKHGQ-UHFFFAOYSA-N InChI=1S/C12H12ClN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-6-4-3-5-8(9)13/h3-7H,1-2H3,(H-,14,15,17,18) CC(C(=O)Nc1ccccc1Cl)Sc2c(on[n+]2C)[O-]  
AKOS005251399 313.76 C12 H12 Cl N3 O3 S BFWBJPQJEXMZHM-UHFFFAOYSA-N InChI=1S/C12H12ClN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-5-3-4-8(13)6-9/h3-7H,1-2H3,(H-,14,15,17,18) CC(C(=O)Nc1cccc(c1)Cl)Sc2c(on[n+]2C)[O-]  
AKOS005251400 313.76 C12 H12 Cl N3 O3 S IUMVWXSAJLJAIZ-UHFFFAOYSA-N InChI=1S/C12H12ClN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-5-3-8(13)4-6-9/h3-7H,1-2H3,(H-,14,15,17,18) CC(C(=O)Nc1ccc(cc1)Cl)Sc2c(on[n+]2C)[O-]  
AKOS005252288 313.76 C12 H12 Cl N3 O3 S PPJFJZCJKKJDBU-UHFFFAOYSA-N InChI=1S/C12H12ClN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-5-3-2-4-8(9)13/h2-5H,6-7H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2Cl  
AKOS005252289 313.76 C12 H12 Cl N3 O3 S JZQQQYXRTRUXBS-UHFFFAOYSA-N InChI=1S/C12H12ClN3O3S/c1-16-11(12(18)19-15-16)20-6-5-10(17)14-9-4-2-3-8(13)7-9/h2-4,7H,5-6H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cccc(c2)Cl  
AKOS005252290 313.76 C12 H12 Cl N3 O3 S LNDPWORCKPRBAG-UHFFFAOYSA-N InChI=1S/C12H12ClN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-4-2-8(13)3-5-9/h2-5H,6-7H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)Cl  
AKOS005250513 297.694 C12 H12 Cl N3 O4 CJTVGHOEYIXLIM-UHFFFAOYSA-N InChI=1S/C12H12ClN3O4/c1-6-4-8(9(19-3)5-7(6)13)14-11(17)10-12(18)20-15-16(10)2/h4-5H,1-3H3,(H-,14,15,17,18) Cc1cc(c(cc1Cl)OC)NC(=O)c2c(on[n+]2C)[O-]  
AKOS005251239 329.759 C12 H12 Cl N3 O4 S LLUXHFLHJPYSEK-UHFFFAOYSA-N InChI=1S/C12H12ClN3O4S/c1-16-11(12(18)20-15-16)21-6-10(17)14-7-3-4-9(19-2)8(13)5-7/h3-5H,6H2,1-2H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c(c2)Cl)OC  
AKOS005251240 329.759 C12 H12 Cl N3 O4 S UJALSHGKWMNLJG-UHFFFAOYSA-N InChI=1S/C12H12ClN3O4S/c1-16-11(12(18)20-15-16)21-6-10(17)14-8-5-7(13)3-4-9(8)19-2/h3-5H,6H2,1-2H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCC(=O)Nc2cc(ccc2OC)Cl  
AKOS005250517 313.694 C12 H12 Cl N3 O5 ALCOFFQLHPESHD-UHFFFAOYSA-N InChI=1S/C12H12ClN3O5/c1-16-10(12(18)21-15-16)11(17)14-7-4-6(13)8(19-2)5-9(7)20-3/h4-5H,1-3H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])C(=O)Nc2cc(c(cc2OC)OC)Cl  
AKOS005215077 315.155 C12 H12 Cl2 N4 O2 VCYFDLLCFZVSNZ-UHFFFAOYSA-N InChI=1S/C12H12Cl2N4O2/c1-7(19)16-12-11(5-15)18(17-20-12)6-8-2-3-9(13)4-10(8)14/h2-4H,5-6,15H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2Cl)Cl)CN  
AKOS005214939 265.24 C12 H12 F N3 O3 CYTYEJSXJHECDP-UHFFFAOYSA-N InChI=1S/C12H12FN3O3/c1-8(18)14-12-11(7-17)16(15-19-12)6-9-2-4-10(13)5-3-9/h2-5,17H,6-7H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)F)CO  
AKOS005250245 265.24 C12 H12 F N3 O3 HMNZHOVDXLUDCV-UHFFFAOYSA-N InChI=1S/C12H12FN3O3/c1-15(7-10-12(18)19-14-16(10)2)11(17)8-5-3-4-6-9(8)13/h3-6H,7H2,1-2H3 C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccccc2F  
AKOS005250352 265.24 C12 H12 F N3 O3 AMASDYOETSJLNT-UHFFFAOYSA-N InChI=1S/C12H12FN3O3/c1-15(7-10-12(18)19-14-16(10)2)11(17)8-3-5-9(13)6-4-8/h3-6H,7H2,1-2H3 C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccc(cc2)F  
AKOS005251493 297.305 C12 H12 F N3 O3 S FRHPOJKAVSQVLZ-UHFFFAOYSA-N InChI=1S/C12H12FN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-6-4-3-5-8(9)13/h3-7H,1-2H3,(H-,14,15,17,18) CC(C(=O)Nc1ccccc1F)Sc2c(on[n+]2C)[O-]  
AKOS005251494 297.305 C12 H12 F N3 O3 S GRDNTOKALHMFQC-UHFFFAOYSA-N InChI=1S/C12H12FN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-5-3-8(13)4-6-9/h3-7H,1-2H3,(H-,14,15,17,18) CC(C(=O)Nc1ccc(cc1)F)Sc2c(on[n+]2C)[O-]  
AKOS005252319 297.305 C12 H12 F N3 O3 S RWYMWPMIQRCYQJ-UHFFFAOYSA-N InChI=1S/C12H12FN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-5-3-2-4-8(9)13/h2-5H,6-7H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2F  
AKOS005252320 297.305 C12 H12 F N3 O3 S YNPIRFZRRFVFRA-UHFFFAOYSA-N InChI=1S/C12H12FN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-4-2-8(13)3-5-9/h2-5H,6-7H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)F  
AKOS005251502 405.211 C12 H12 I N3 O3 S XDLYYDKJEDGTQW-UHFFFAOYSA-N InChI=1S/C12H12IN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-5-3-8(13)4-6-9/h3-7H,1-2H3,(H-,14,15,17,18) CC(C(=O)Nc1ccc(cc1)I)Sc2c(on[n+]2C)[O-]  
AKOS005252329 405.211 C12 H12 I N3 O3 S FUVRFCLOQXZDCX-UHFFFAOYSA-N InChI=1S/C12H12IN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-4-2-8(13)3-5-9/h2-5H,6-7H2,1H3,(H-,14,15,17,18) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)I  
AKOS005215728 216.236 C12 H12 N2 O2 XDTJFVDUWHVEER-UHFFFAOYSA-N InChI=1S/C12H12N2O2/c1-2-3-9-14-11(12(15)16-13-14)10-7-5-4-6-8-10/h2,4-8H,1,3,9H2 C=CCC[n+]1c(c(on1)[O-])c2ccccc2 MFCD09881652
AKOS005219527 264.3 C12 H12 N2 O3 S LZOCOMXORRRHEK-UHFFFAOYSA-N InChI=1S/C12H12N2O3S/c1-8-3-5-9(6-4-8)18-7-10(15)11-12(16)17-13-14(11)2/h3-6H,7H2,1-2H3 Cc1ccc(cc1)SCC(=O)c2c(on[n+]2C)[O-]  
AKOS005250688 264.3 C12 H12 N2 O3 S CWPQQSLOXPKGKF-UHFFFAOYSA-N InChI=1S/C12H12N2O3S/c1-14-11(12(16)17-13-14)10(15)8-18-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3 C[n+]1c(c(on1)[O-])C(=O)CSCc2ccccc2  
AKOS005219537 280.3 C12 H12 N2 O4 S YQPHUSBUPYHVPR-UHFFFAOYSA-N InChI=1S/C12H12N2O4S/c1-2-17-10(15)8-19-11-12(16)18-13-14(11)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3 CCOC(=O)CSc1c(on[n+]1c2ccccc2)[O-]  
AKOS005215593 260.249 C12 H12 N4 O3 PPTAOVGWQGFYCC-UHFFFAOYSA-N InChI=1S/C12H12N4O3/c1-15(2)16-10(8-17)12(19-14-16)13-11(18)9-6-4-3-5-7-9/h3-8H,1-2H3 CN(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C=O  
AKOS005219742 276.248 C12 H12 N4 O4 KFSMBXZSKMYILI-UHFFFAOYSA-N InChI=1S/C12H12N4O4/c1-5(17)8-6(2)19-11(14)7(4-13)9(8)10-12(18)20-15-16(10)3/h9H,14H2,1-3H3 CC1=C(C(C(=C(O1)N)C#N)c2c(on[n+]2C)[O-])C(=O)C  
AKOS005250544 276.248 C12 H12 N4 O4 DFLYIYCCEOZYNC-UHFFFAOYSA-N InChI=1S/C12H12N4O4/c1-7(17)13-8-3-5-9(6-4-8)14-11(18)10-12(19)20-15-16(10)2/h3-6,15H,1-2H3,(H,18,19) CC(=O)Nc1ccc(cc1)NC(=O)c2c(on[n+]2C)[O-]  
AKOS005251118 308.313 C12 H12 N4 O4 S IDNOMIQLBXSEDH-UHFFFAOYSA-N InChI=1S/C12H12N4O4S/c1-16-11(12(19)20-15-16)21-6-9(17)14-8-4-2-7(3-5-8)10(13)18/h2-5H,6H2,1H3,(H3-,13,14,15,17,18,19) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)C(=O)N  
AKOS005251119 308.313 C12 H12 N4 O4 S GRPPMXFCJWFJCP-UHFFFAOYSA-N InChI=1S/C12H12N4O4S/c1-16-11(12(19)20-15-16)21-6-9(17)14-8-5-3-2-4-7(8)10(13)18/h2-5H,6H2,1H3,(H3-,13,14,15,17,18,19) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2C(=O)N  
AKOS005250363 292.247 C12 H12 N4 O5 ACDUHXIIOLKNTD-UHFFFAOYSA-N InChI=1S/C12H12N4O5/c1-14(7-10-12(18)21-13-15(10)2)11(17)8-4-3-5-9(6-8)16(19)20/h3-6H,7H2,1-2H3 C[n+]1c(c(on1)[O-])CN(C)C(=O)c2cccc(c2)[N+](=O)[O-]  
AKOS005250364 292.247 C12 H12 N4 O5 FEYXKWNPIPTPCV-UHFFFAOYSA-N InChI=1S/C12H12N4O5/c1-14(7-10-12(18)21-13-15(10)2)11(17)8-3-5-9(6-4-8)16(19)20/h3-6H,7H2,1-2H3/q-2 C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccc(cc2)[N-](=O)[O-]  
AKOS005251247 324.312 C12 H12 N4 O5 S IXIWADXIGOOOAX-UHFFFAOYSA-N InChI=1S/C12H12N4O5S/c1-7-5-8(16(19)20)3-4-9(7)13-10(17)6-22-11-12(18)21-14-15(11)2/h3-5H,6H2,1-2H3,(H-,13,14,17,18) Cc1cc(ccc1NC(=O)CSc2c(on[n+]2C)[O-])[N+](=O)[O-]  
AKOS005251248 324.312 C12 H12 N4 O5 S GRGKNQDCIAHWJC-UHFFFAOYSA-N InChI=1S/C12H12N4O5S/c1-7-3-4-8(16(19)20)5-9(7)13-10(17)6-22-11-12(18)21-14-15(11)2/h3-5H,6H2,1-2H3,(H-,13,14,17,18) Cc1ccc(cc1NC(=O)CSc2c(on[n+]2C)[O-])[N+](=O)[O-]  
AKOS005250105 320.327 C12 H12 N6 O3 S MJLUTDXKDPSRME-UHFFFAOYSA-N InChI=1S/C12H12N6O3S/c1-20-7-4-2-6(3-5-7)18-8(10(19)21-17-18)9-14-11(13)16-12(22)15-9/h2-5,9H,1H3,(H4-,13,14,15,16,17,19,22) COc1ccc(cc1)[n+]2c(c(on2)[O-])C3NC(=NC(=N3)N)S  
AKOS005214863 280.71 C12 H13 Cl N4 O2 ZIMZCEOYRIPOTO-UHFFFAOYSA-N InChI=1S/C12H13ClN4O2/c1-8(18)15-12-11(6-14)17(16-19-12)7-9-4-2-3-5-10(9)13/h2-5H,6-7,14H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccccc2Cl)CN  
AKOS005252677 312.775 C12 H13 Cl N4 O2 S OPUWPWDGUWPGJC-UHFFFAOYSA-N InChI=1S/C12H13ClN4O2S/c1-16(2)17-7-12(19-15-17)14-11(18)8-20-10-5-3-9(13)4-6-10/h3-7H,8H2,1-2H3 CN(C)[n+]1cc(on1)[N-]C(=O)CSc2ccc(cc2)Cl  
AKOS005214336 302.157 C12 H13 Cl2 N3 O2 WILYGLACGLIZGZ-UHFFFAOYSA-N InChI=1S/C12H13Cl2N3O2/c1-17-11(12(18)19-16-17)7-15-5-4-8-2-3-9(13)6-10(8)14/h2-3,6,15H,4-5,7H2,1H3 C[n+]1c(c(on1)[O-])CNCCc2ccc(cc2Cl)Cl  
AKOS005215078 264.256 C12 H13 F N4 O2 UUOQKWSQOSLZIT-UHFFFAOYSA-N InChI=1S/C12H13FN4O2/c1-8(18)15-12-11(6-14)17(16-19-12)7-9-2-4-10(13)5-3-9/h2-5H,6-7,14H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)F)CN  
AKOS005214157 231.251 C12 H13 N3 O2 WFTVDGZOYHJZQA-UHFFFAOYSA-N InChI=1S/C12H13N3O2/c1-2-8-13-9-11-12(16)17-14-15(11)10-6-4-3-5-7-10/h2-7,13H,1,8-9H2 C=CCNCc1c(on[n+]1c2ccccc2)[O-]  
AKOS005214318 231.251 C12 H13 N3 O2 YDQMZWOLYHZANP-UHFFFAOYSA-N InChI=1S/C12H13N3O2/c16-12-11(8-13-9-6-7-9)15(14-17-12)10-4-2-1-3-5-10/h1-5,9,13H,6-8H2 c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC3  
AKOS005215473 231.251 C12 H13 N3 O2 FFGGAXRNIDFSGS-UHFFFAOYSA-N InChI=1S/C12H13N3O2/c1-9(2)15-8-11(17-14-15)13-12(16)10-6-4-3-5-7-10/h3-9H,1-2H3 CC(C)[n+]1cc(on1)[N-]C(=O)c2ccccc2 MFCD09881636
AKOS005215543 231.251 C12 H13 N3 O2 NPZHWJLMKDFLHI-UHFFFAOYSA-N InChI=1S/C12H13N3O2/c1-9-3-5-11(6-4-9)7-15-8-12(17-14-15)13-10(2)16/h3-6,8H,7H2,1-2H3 Cc1ccc(cc1)C[n+]2cc(on2)[N-]C(=O)C  
AKOS005215556 231.251 C12 H13 N3 O2 YPFATSUBXQGRQQ-UHFFFAOYSA-N InChI=1S/C12H13N3O2/c1-10(16)13-12-9-15(14-17-12)8-7-11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3 CC(=O)[N-]c1c[n+](no1)CCc2ccccc2  
AKOS005215586 263.316 C12 H13 N3 O2 S PDPRXMBMVTZNND-AATRIKPKSA-N InChI=1S/C12H13N3O2S/c1-9(2)15-8-12(17-14-15)13-11(16)6-5-10-4-3-7-18-10/h3-9H,1-2H3/b6-5+ CC(C)[n+]1cc(on1)[N-]C(=O)/C=C/c2cccs2  
AKOS005252444 263.316 C12 H13 N3 O2 S IYOFATGNCUAFBY-UHFFFAOYSA-N InChI=1S/C12H13N3O2S/c1-2-15-8-12(17-14-15)13-11(16)9-18-10-6-4-3-5-7-10/h3-8H,2,9H2,1H3 CC[n+]1cc(on1)[N-]C(=O)CSc2ccccc2  
AKOS005252604 263.316 C12 H13 N3 O2 S UDXKIXLQDSOMQU-UHFFFAOYSA-N InChI=1S/C12H13N3O2S/c1-15-7-12(17-14-15)13-11(16)9-18-8-10-5-3-2-4-6-10/h2-7H,8-9H2,1H3 C[n+]1cc(on1)[N-]C(=O)CSCc2ccccc2  
AKOS005252626 263.316 C12 H13 N3 O2 S CXKBYBNFCHPTJG-UHFFFAOYSA-N InChI=1S/C12H13N3O2S/c1-9-3-5-10(6-4-9)18-8-11(16)13-12-7-15(2)14-17-12/h3-7H,8H2,1-2H3 Cc1ccc(cc1)SCC(=O)[N-]c2c[n+](no2)C  
AKOS005214926 247.25 C12 H13 N3 O3 APBFQZPQTYRGPC-UHFFFAOYSA-N InChI=1S/C12H13N3O3/c1-9(17)13-12-11(8-16)15(14-18-12)7-10-5-3-2-4-6-10/h2-6,16H,7-8H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccccc2)CO  
AKOS005215504 247.25 C12 H13 N3 O3 LXXXCQHJSGOZCY-UHFFFAOYSA-N InChI=1S/C12H13N3O3/c1-17-8-7-15-9-11(18-14-15)13-12(16)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3 COCC[n+]1cc(on1)[N-]C(=O)c2ccccc2  
AKOS005215532 247.25 C12 H13 N3 O3 NATQSKIHKVZKGY-UHFFFAOYSA-N InChI=1S/C12H13N3O3/c1-8(16)13-12-11(15(2)14-18-12)9-5-4-6-10(7-9)17-3/h4-7H,1-3H3 CC(=O)[N-]c1c([n+](no1)C)c2cccc(c2)OC  
AKOS005215544 247.25 C12 H13 N3 O3 QPUHKQCVSKLPNQ-UHFFFAOYSA-N InChI=1S/C12H13N3O3/c1-9(16)13-12-8-15(14-18-12)7-10-3-5-11(17-2)6-4-10/h3-6,8H,7H2,1-2H3 CC(=O)[N-]c1c[n+](no1)Cc2ccc(cc2)OC  
AKOS005250369 247.25 C12 H13 N3 O3 HUZUZWSOBCETIR-UHFFFAOYSA-N InChI=1S/C12H13N3O3/c1-9(16)14(2)8-11-12(17)18-13-15(11)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3 CC(=O)N(C)Cc1c(on[n+]1c2ccccc2)[O-]  
AKOS005250523 247.25 C12 H13 N3 O3 GGFJXHTUCCLQPA-UHFFFAOYSA-N InChI=1S/C12H13N3O3/c1-7-5-4-6-8(2)9(7)13-11(16)10-12(17)18-14-15(10)3/h4-6H,1-3H3,(H-,13,14,16,17) Cc1cccc(c1NC(=O)c2c(on[n+]2C)[O-])C  
AKOS005250638 247.25 C12 H13 N3 O3 QPTNJEZHEMWAPJ-UHFFFAOYSA-N InChI=1S/C12H13N3O3/c1-7-5-4-6-9(8(7)2)13-11(16)10-12(17)18-14-15(10)3/h4-6H,1-3H3,(H-,13,14,16,17) Cc1cccc(c1C)NC(=O)c2c(on[n+]2C)[O-]  
AKOS005250639 247.25 C12 H13 N3 O3 SBYOKSIBQYRIAQ-UHFFFAOYSA-N InChI=1S/C12H13N3O3/c1-7-4-5-9(8(2)6-7)13-11(16)10-12(17)18-14-15(10)3/h4-6H,1-3H3,(H-,13,14,16,17) Cc1ccc(c(c1)C)NC(=O)c2c(on[n+]2C)[O-]  
AKOS005250649 247.25 C12 H13 N3 O3 AQWQZDBQSUBLAZ-UHFFFAOYSA-N InChI=1S/C12H13N3O3/c1-7-4-5-8(2)9(6-7)13-11(16)10-12(17)18-14-15(10)3/h4-6H,1-3H3,(H-,13,14,16,17) Cc1ccc(c(c1)NC(=O)c2c(on[n+]2C)[O-])C  
AKOS005250650 247.25 C12 H13 N3 O3 SURAIOCZSWORJF-UHFFFAOYSA-N InChI=1S/C12H13N3O3/c1-7-4-5-9(6-8(7)2)13-11(16)10-12(17)18-14-15(10)3/h4-6H,1-3H3,(H-,13,14,16,17) Cc1ccc(cc1C)NC(=O)c2c(on[n+]2C)[O-]  
AKOS005250651 247.25 C12 H13 N3 O3 NDHXALGBIUVZQL-UHFFFAOYSA-N InChI=1S/C12H13N3O3/c1-7-4-8(2)6-9(5-7)13-11(16)10-12(17)18-14-15(10)3/h4-6H,1-3H3,(H-,13,14,16,17) Cc1cc(cc(c1)NC(=O)c2c(on[n+]2C)[O-])C  
AKOS005251241 279.315 C12 H13 N3 O3 S HQQIVBRHBJXDRJ-UHFFFAOYSA-N InChI=1S/C12H13N3O3S/c1-8-5-3-4-6-9(8)13-10(16)7-19-11-12(17)18-14-15(11)2/h3-6H,7H2,1-2H3,(H-,13,14,16,17) Cc1ccccc1NC(=O)CSc2c(on[n+]2C)[O-]  
AKOS005251242 279.315 C12 H13 N3 O3 S RYAQWXJIHGDBHY-UHFFFAOYSA-N InChI=1S/C12H13N3O3S/c1-8-4-3-5-9(6-8)13-10(16)7-19-11-12(17)18-14-15(11)2/h3-6H,7H2,1-2H3,(H-,13,14,16,17) Cc1cccc(c1)NC(=O)CSc2c(on[n+]2C)[O-]  
AKOS005251243 279.315 C12 H13 N3 O3 S UBGMVTNYGVEGDW-UHFFFAOYSA-N InChI=1S/C12H13N3O3S/c1-8-3-5-9(6-4-8)13-10(16)7-19-11-12(17)18-14-15(11)2/h3-6H,7H2,1-2H3,(H-,13,14,16,17) Cc1ccc(cc1)NC(=O)CSc2c(on[n+]2C)[O-]  
AKOS005251392 279.315 C12 H13 N3 O3 S JJQLZZQGRKBZHF-UHFFFAOYSA-N InChI=1S/C12H13N3O3S/c1-8(19-11-12(17)18-14-15(11)2)10(16)13-9-6-4-3-5-7-9/h3-8H,1-2H3,(H-,13,14,16,17) CC(C(=O)Nc1ccccc1)Sc2c(on[n+]2C)[O-]  
AKOS005252281 279.315 C12 H13 N3 O3 S MHCPXBCNWGJITJ-UHFFFAOYSA-N InChI=1S/C12H13N3O3S/c1-15-11(12(17)18-14-15)19-8-7-10(16)13-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2  
AKOS005214277 263.249 C12 H13 N3 O4 XOWBWMMDKSOTJS-UHFFFAOYSA-N InChI=1S/C12H13N3O4/c1-15-9(12(16)19-14-15)6-13-5-8-2-3-10-11(4-8)18-7-17-10/h2-4,13H,5-7H2,1H3 C[n+]1c(c(on1)[O-])CNCc2ccc3c(c2)OCO3  
AKOS005250534 263.249 C12 H13 N3 O4 NOGBFMCFPRRBOQ-UHFFFAOYSA-N InChI=1S/C12H13N3O4/c1-3-18-9-7-5-4-6-8(9)13-11(16)10-12(17)19-14-15(10)2/h4-7H,3H2,1-2H3,(H-,13,14,16,17) CCOc1ccccc1NC(=O)c2c(on[n+]2C)[O-]  
AKOS005250535 263.249 C12 H13 N3 O4 MGXSBPAIDYCILU-UHFFFAOYSA-N InChI=1S/C12H13N3O4/c1-3-18-9-6-4-8(5-7-9)13-11(16)10-12(17)19-14-15(10)2/h4-7H,3H2,1-2H3,(H-,13,14,16,17) CCOc1ccc(cc1)NC(=O)c2c(on[n+]2C)[O-]  
AKOS005251109 295.314 C12 H13 N3 O4 S KTIZWCHRKXJSMN-UHFFFAOYSA-N InChI=1S/C12H13N3O4S/c1-15-11(12(17)19-14-15)20-7-10(16)13-8-5-3-4-6-9(8)18-2/h3-6H,7H2,1-2H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2OC  
AKOS005251110 295.314 C12 H13 N3 O4 S SEHQPABINUCJCI-UHFFFAOYSA-N InChI=1S/C12H13N3O4S/c1-15-11(12(17)19-14-15)20-7-10(16)13-8-4-3-5-9(6-8)18-2/h3-6H,7H2,1-2H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCC(=O)Nc2cccc(c2)OC  
AKOS005251223 295.314 C12 H13 N3 O4 S XIFSBYRRBSPZDL-UHFFFAOYSA-N InChI=1S/C12H13N3O4S/c1-15-11(12(17)19-14-15)20-7-10(16)13-8-3-5-9(18-2)6-4-8/h3-6H,7H2,1-2H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)OC  
AKOS005250520 279.249 C12 H13 N3 O5 LPRNFPWCDQQIKG-UHFFFAOYSA-N InChI=1S/C12H13N3O5/c1-15-10(12(17)20-14-15)11(16)13-8-5-4-7(18-2)6-9(8)19-3/h4-6H,1-3H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2OC)OC  
AKOS005250521 279.249 C12 H13 N3 O5 YWZXXJPMSZTOCZ-UHFFFAOYSA-N InChI=1S/C12H13N3O5/c1-15-10(12(17)20-14-15)11(16)13-8-6-7(18-2)4-5-9(8)19-3/h4-6H,1-3H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2cc(ccc2OC)OC  
AKOS005250522 279.249 C12 H13 N3 O5 HJVZNAMRXSVSFK-UHFFFAOYSA-N InChI=1S/C12H13N3O5/c1-15-10(12(17)20-14-15)11(16)13-7-4-8(18-2)6-9(5-7)19-3/h4-6H,1-3H3,(H-,13,14,16,17) C[n+]1c(c(on1)[O-])C(=O)Nc2cc(cc(c2)OC)OC  
AKOS005250655 279.249 C12 H13 N3 O5 IHQGQQATHHDCTL-UHFFFAOYSA-N InChI=1S/C12H13N3O5/c1-19-9-4-2-8(3-5-9)15-10(12(18)20-14-15)11(17)13-6-7-16/h2-5,16H,6-7H2,1H3,(H-,13,14,17,18) COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCO  
AKOS005214251 267.711 C12 H14 Cl N3 O2 LLQZSJSQOCKSKK-UHFFFAOYSA-N InChI=1S/C12H14ClN3O2/c1-16-11(12(17)18-15-16)8-14-6-5-9-3-2-4-10(13)7-9/h2-4,7,14H,5-6,8H2,1H3 C[n+]1c(c(on1)[O-])CNCCc2cccc(c2)Cl  
AKOS005214334 267.711 C12 H14 Cl N3 O2 BPRKDRGDJGKLNU-UHFFFAOYSA-N InChI=1S/C12H14ClN3O2/c1-16-11(12(17)18-15-16)8-14-7-6-9-4-2-3-5-10(9)13/h2-5,14H,6-8H2,1H3 C[n+]1c(c(on1)[O-])CNCCc2ccccc2Cl  
AKOS005214335 267.711 C12 H14 Cl N3 O2 QZJRMFWNFRJKEO-UHFFFAOYSA-N InChI=1S/C12H14ClN3O2/c1-16-11(12(17)18-15-16)8-14-7-6-9-2-4-10(13)5-3-9/h2-5,14H,6-8H2,1H3 C[n+]1c(c(on1)[O-])CNCCc2ccc(cc2)Cl  
AKOS005214326 251.257 C12 H14 F N3 O2 CCHHOHZYRCINIG-UHFFFAOYSA-N InChI=1S/C12H14FN3O2/c1-16-11(12(17)18-15-16)8-14-7-6-9-2-4-10(13)5-3-9/h2-5,14H,6-8H2,1H3 C[n+]1c(c(on1)[O-])CNCCc2ccc(cc2)F  
AKOS005214327 251.257 C12 H14 F N3 O2 WJTAISZKJLUJPZ-UHFFFAOYSA-N InChI=1S/C12H14FN3O2/c1-16-11(12(17)18-15-16)8-14-7-6-9-4-2-3-5-10(9)13/h2-5,14H,6-8H2,1H3 C[n+]1c(c(on1)[O-])CNCCc2ccccc2F  
AKOS005215064 246.265 C12 H14 N4 O2 YIWGGWJDNMMJKE-UHFFFAOYSA-N InChI=1S/C12H14N4O2/c1-9(17)14-12-11(7-13)16(15-18-12)8-10-5-3-2-4-6-10/h2-6H,7-8,13H2,1H3 CC(=O)[N-]c1c([n+](no1)Cc2ccccc2)CN  
AKOS005215587 278.33 C12 H14 N4 O2 S RRTGUKPKWNDWLD-UHFFFAOYSA-N InChI=1S/C12H14N4O2S/c1-15(2)16-12(19-3)11(18-14-16)13-10(17)9-7-5-4-6-8-9/h4-8H,1-3H3 CN(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)SC  
AKOS005219854 278.33 C12 H14 N4 O2 S MWPKRJALCHGIMJ-UHFFFAOYSA-N InChI=1S/C12H14N4O2S/c1-15(8-10-11(17)18-14-16(10)2)12(19)13-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H-,13,14,17,19) C[n+]1c(c(on1)[O-])CN(C)C(=S)Nc2ccccc2  
AKOS005219884 278.33 C12 H14 N4 O2 S YLAOPHBKNLXOHB-UHFFFAOYSA-N InChI=1S/C12H14N4O2S/c1-13-12(19)15(2)8-10-11(17)18-14-16(10)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H-,13,14,17,19) CNC(=S)N(C)Cc1c(on[n+]1c2ccccc2)[O-]  
AKOS005252682 278.33 C12 H14 N4 O2 S DBAKSFABVJNZSE-UHFFFAOYSA-N InChI=1S/C12H14N4O2S/c1-15(2)16-8-12(18-14-16)13-11(17)9-19-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3 CN(C)[n+]1cc(on1)[N-]C(=O)CSc2ccccc2  
AKOS005252822 278.33 C12 H14 N4 O2 S KENKODFEUTZWGF-UHFFFAOYSA-N InChI=1S/C12H14N4O2S/c1-2-16-7-12(18-15-16)14-11(17)8-19-10-5-3-4-9(13)6-10/h3-7H,2,8,13H2,1H3 CC[n+]1cc(on1)[N-]C(=O)CSc2cccc(c2)N  
AKOS005252829 278.33 C12 H14 N4 O2 S SLDOPTHOBZOCHB-UHFFFAOYSA-N InChI=1S/C12H14N4O2S/c1-9(2)16-7-11(18-15-16)14-10(17)8-19-12-5-3-4-6-13-12/h3-7,9H,8H2,1-2H3 CC(C)[n+]1cc(on1)[N-]C(=O)CSc2ccccn2  
AKOS005253348 294.33 C12 H14 N4 O3 S MVDUDFHOAQOXOZ-UHFFFAOYSA-N InChI=1S/C12H14N4O3S/c1-18-7-6-16-8-11(19-15-16)14-10(17)9-20-12-4-2-3-5-13-12/h2-5,8H,6-7,9H2,1H3 COCC[n+]1cc(on1)[N-]C(=O)CSc2ccccn2  
AKOS005215595 310.329 C12 H14 N4 O4 S KWNSAPFZTQVDMD-UHFFFAOYSA-N InChI=1S/C12H14N4O4S/c1-9-4-6-10(7-5-9)21(18,19)13-12-11(8-17)16(14-20-12)15(2)3/h4-8H,1-3H3 Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)N(C)C)C=O  
AKOS005251456 358.393 C12 H14 N4 O5 S2 BKSASEWQHKHGFC-UHFFFAOYSA-N InChI=1S/C12H14N4O5S2/c1-7(22-11-12(18)21-15-16(11)2)10(17)14-8-3-5-9(6-4-8)23(13,19)20/h3-7H,1-2H3,(H3-,13,14,15,17,18,19,20) CC(C(=O)Nc1ccc(cc1)S(=O)(=O)N)Sc2c(on[n+]2C)[O-]  
AKOS005252381 358.393 C12 H14 N4 O5 S2 SPKULBGOMZTEIB-UHFFFAOYSA-N InChI=1S/C12H14N4O5S2/c1-16-11(12(18)21-15-16)22-7-6-10(17)14-8-2-4-9(5-3-8)23(13,19)20/h2-5H,6-7H2,1H3,(H3-,13,14,15,17,18,19,20) C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)S(=O)(=O)N  
AKOS005252934 322.343 C12 H14 N6 O3 S PVMNUQFQQOYGJN-UHFFFAOYSA-N InChI=1S/C12H14N6O3S/c19-10(9-22-12-13-2-1-3-14-12)15-11-8-18(16-21-11)17-4-6-20-7-5-17/h1-3,8H,4-7,9H2 c1cnc(nc1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3  
AKOS005253032 354.342 C12 H14 N6 O5 S UFMZHDZMBNFOOE-UHFFFAOYSA-N InChI=1S/C12H14N6O5S/c19-8-5-9(20)15-12(14-8)24-7-10(21)13-11-6-18(16-23-11)17-1-3-22-4-2-17/h5-6H,1-4,7H2,(H2-,13,14,15,16,19,20,21) c1c(nc(nc1O)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)O  
AKOS005214265 233.266 C12 H15 N3 O2 HWXRBBZMYOILHR-UHFFFAOYSA-N InChI=1S/C12H15N3O2/c1-9(10-6-4-3-5-7-10)13-8-11-12(16)17-14-15(11)2/h3-7,9,13H,8H2,1-2H3 CC(c1ccccc1)NCc2c(on[n+]2C)[O-]  
AKOS005214275 233.266 C12 H15 N3 O2 BEYTWVVJDUPKBS-UHFFFAOYSA-N InChI=1S/C12H15N3O2/c1-9-3-5-10(6-4-9)7-13-8-11-12(16)17-14-15(11)2/h3-6,13H,7-8H2,1-2H3 Cc1ccc(cc1)CNCc2c(on[n+]2C)[O-]  
AKOS005214276 233.266 C12 H15 N3 O2 PZWHBWDOHMLDKS-UHFFFAOYSA-N InChI=1S/C12H15N3O2/c1-15-11(12(16)17-14-15)9-13-8-7-10-5-3-2-4-6-10/h2-6,13H,7-9H2,1H3 C[n+]1c(c(on1)[O-])CNCCc2ccccc2  
AKOS005219452 233.266 C12 H15 N3 O2 OUTUJFOQRTZGIN-UHFFFAOYSA-N InChI=1S/C12H15N3O2/c1-9(2)13-8-11-12(16)17-14-15(11)10-6-4-3-5-7-10/h3-7,9,13H,8H2,1-2H3 CC(C)NCc1c(on[n+]1c2ccccc2)[O-]  
AKOS005215597 269.727 C12 H15 N3 O2 . Cl H SAVFWCIAVNWUEJ-UHFFFAOYSA-N InChI=1S/C12H15N3O2.ClH/c1-9(2)13-8-11-12(16)17-14-15(11)10-6-4-3-5-7-10;/h3-7,9,13H,8H2,1-2H3;1H CC(C)NCc1c(on[n+]1c2ccccc2)[O-].Cl  
AKOS005214797 249.266 C12 H15 N3 O3 YLYJXLWFLQZJOR-UHFFFAOYSA-N InChI=1S/C12H15N3O3/c1-9-2-4-10(5-3-9)15-11(8-13-6-7-16)12(17)18-14-15/h2-5,13,16H,6-8H2,1H3 Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCO  
AKOS005215423 281.331 C12 H15 N3 O3 S ZRFTUDIMELQWOD-UHFFFAOYSA-N InChI=1S/C12H15N3O3S/c1-9(2)15-8-12(18-14-15)13-19(16,17)11-6-4-10(3)5-7-11/h4-9H,1-3H3 Cc1ccc(cc1)S(=O)(=O)[N-]c2c[n+](no2)C(C)C  
AKOS005252858 281.331 C12 H15 N3 O3 S QFXJFPHGTPWBJK-UHFFFAOYSA-N InChI=1S/C12H15N3O3S/c1-9(2)15-6-12(18-14-15)13-11(16)8-19-7-10-4-3-5-17-10/h3-6,9H,7-8H2,1-2H3 CC(C)[n+]1cc(on1)[N-]C(=O)CSCc2ccco2  
AKOS005214814 265.265 C12 H15 N3 O4 ROODHNNFLCFHJL-UHFFFAOYSA-N InChI=1S/C12H15N3O4/c1-18-10-4-2-9(3-5-10)15-11(8-13-6-7-16)12(17)19-14-15/h2-5,13,16H,6-8H2,1H3 COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCO  
AKOS005215516 297.33 C12 H15 N3 O4 S YTCJXQXRALKDNO-UHFFFAOYSA-N InChI=1S/C12H15N3O4S/c1-10-3-5-11(6-4-10)20(16,17)13-12-9-15(14-19-12)7-8-18-2/h3-6,9H,7-8H2,1-2H3 Cc1ccc(cc1)S(=O)(=O)[N-]c2c[n+](no2)CCOC  
AKOS005253391 297.33 C12 H15 N3 O4 S GEFDIVFZVYJOSQ-UHFFFAOYSA-N InChI=1S/C12H15N3O4S/c1-17-6-4-15-7-12(19-14-15)13-11(16)9-20-8-10-3-2-5-18-10/h2-3,5,7H,4,6,8-9H2,1H3 COCC[n+]1cc(on1)[N-]C(=O)CSCc2ccco2  
AKOS005252505 293.345 C12 H15 N5 O2 S QHONTPBKSVYYGB-UHFFFAOYSA-N InChI=1S/C12H15N5O2S/c1-4-17-6-11(19-16-17)15-10(18)7-20-12-13-8(2)5-9(3)14-12/h5-6H,4,7H2,1-3H3 CC[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)C)C  
AKOS005253137 293.345 C12 H15 N5 O2 S ZLHYZXTYQNXMSD-UHFFFAOYSA-N InChI=1S/C12H15N5O2S/c1-16(2)17-7-12(19-15-17)14-11(18)8-20-10-5-3-4-9(13)6-10/h3-7H,8,13H2,1-2H3 CN(C)[n+]1cc(on1)[N-]C(=O)CSc2cccc(c2)N  
AKOS005215664 248.353 C12 H16 N2 O2 Si GDFCEDUOTZGUCK-UHFFFAOYSA-N InChI=1S/C12H16N2O2Si/c1-17(2,3)9-14-11(12(15)16-13-14)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3 C[Si](C)(C)C[n+]1c(c(on1)[O-])c2ccccc2 MFCD09881649
AKOS005215562 285.727 C12 H16 N3 O3 . Cl IFXCFKKPCYIYIU-UHFFFAOYSA-M InChI=1S/C12H16N3O3.ClH/c1-16-10-4-3-9(7-11(10)17-2)5-6-15-8-12(13)18-14-15;/h3-4,7-8H,5-6,13H2,1-2H3;1H/q+1;/p-1 COc1ccc(cc1OC)CC[n+]2cc(on2)N.[Cl-]  
AKOS005214256 248.281 C12 H16 N4 O2 WTXGRKXJTSPOFQ-UHFFFAOYSA-N InChI=1S/C12H16N4O2/c1-9(2)16-11(12(17)18-15-16)8-14-7-10-4-3-5-13-6-10/h3-6,9,14H,7-8H2,1-2H3 CC(C)[n+]1c(c(on1)[O-])CNCc2cccnc2  
AKOS005252821 280.346 C12 H16 N4 O2 S NCUXIIUUJJZYSL-UHFFFAOYSA-N InChI=1S/C12H16N4O2S/c1-2-16-7-12(18-15-16)14-11(17)8-19-10-5-3-9(13)4-6-10/h3,5,7H,2,4,6,8,13H2,1H3 CC[n+]1cc(on1)[N-]C(=O)CSC2=CC=C(CC2)N  
AKOS005215673 296.345 C12 H16 N4 O3 S ZEBZTWMLPDDBDJ-UHFFFAOYSA-N InChI=1S/C12H16N4O3S/c1-12(2,3)11(18)14-9-7(16(4)15-19-9)8(17)10-13-5-6-20-10/h5-6,8,17H,1-4H3 CC(C)(C)C(=O)[N-]c1c([n+](no1)C)C(c2nccs2)O  
AKOS005215660 280.28 C12 H16 N4 O4 RYMYAGVUNWYFJG-UHFFFAOYSA-N InChI=1S/C12H16N4O4/c1-8(17)13-12-10(11(18)9-2-3-9)16(14-20-12)15-4-6-19-7-5-15/h9H,2-7H2,1H3 CC(=O)[N-]c1c([n+](no1)N2CCOCC2)C(=O)C3CC3  
AKOS005214314 312.345 C12 H16 N4 O4 S DARGYZJGDWZQBE-UHFFFAOYSA-N InChI=1S/C12H16N4O4S/c1-16-11(12(17)20-15-16)8-14-7-6-9-2-4-10(5-3-9)21(13,18)19/h2-5,14H,6-8H2,1H3,(H2-,13,15,17,18,19) C[n+]1c(c(on1)[O-])CNCCc2ccc(cc2)S(=O)(=O)N  
AKOS005252675 308.359 C12 H16 N6 O2 S UPSIIUSVZRUHIN-UHFFFAOYSA-N InChI=1S/C12H16N6O2S/c1-8-5-9(2)14-12(13-8)21-7-10(19)15-11-6-18(16-20-11)17(3)4/h5-6H,7H2,1-4H3 Cc1cc(nc(n1)SCC(=O)[N-]c2c[n+](no2)N(C)C)C  
AKOS005253048 340.424 C12 H16 N6 O2 S2 KBIZXNZTBNUHFE-UHFFFAOYSA-N InChI=1S/C12H16N6O2S2/c1-9-14-15-12(22-9)21-8-10(19)13-11-7-18(16-20-11)17-5-3-2-4-6-17/h7H,2-6,8H2,1H3 Cc1nnc(s1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3  
AKOS005252933 324.359 C12 H16 N6 O3 S CYVVMACCTCVTDQ-UHFFFAOYSA-N InChI=1S/C12H16N6O3S/c1-16-3-2-13-12(16)22-9-10(19)14-11-8-18(15-21-11)17-4-6-20-7-5-17/h2-3,8H,4-7,9H2,1H3 Cn1ccnc1SCC(=O)[N-]c2c[n+](no2)N3CCOCC3  
AKOS005253162 336.373 C12 H16 N8 O2 S YOOVKKCXWJTSHH-UHFFFAOYSA-N InChI=1S/C12H16N8O2S/c13-11-14-8-15-12(17-11)23-7-9(21)16-10-6-20(18-22-10)19-4-2-1-3-5-19/h6,8H,1-5,7H2,(H2-,13,14,15,16,17,18,21) c1c(on[n+]1N2CCCCC2)[N-]C(=O)CSc3ncnc(n3)N  
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AKOS005215579 268.312 C12 H20 N4 O3 WEWYALARALRWIK-UHFFFAOYSA-N InChI=1S/C12H20N4O3/c1-12(2,3)18-11(17)13-10-9-16(14-19-10)15-7-5-4-6-8-15/h9H,4-8H2,1-3H3 CC(C)(C)OC(=O)[N-]c1c[n+](no1)N2CCCCC2  
AKOS005214858 284.312 C12 H20 N4 O4 CBECHJAMRHIFIF-UHFFFAOYSA-N InChI=1S/C12H20N4O4/c1-9(17)11-12(13-10(2)18)20-14-16(11)4-3-15-5-7-19-8-6-15/h9,17H,3-8H2,1-2H3 CC(c1c(on[n+]1CCN2CCOCC2)[N-]C(=O)C)O