ID large_stringlengths 1 7 | smiles stringlengths 15 57 | selfies stringlengths 55 294 | safe stringlengths 15 83 |
|---|---|---|---|
44471 | Cc1ccccc1NC(=O)CN1C(=O)COc2ccccc21 | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O] | C3(=O)CN1C(=O)COc2ccccc21.Cc1ccccc14.N34 |
44472 | Cc1cccc(C)c1NC(=O)CN1C(=O)COc2ccccc21 | [C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O] | C3(=O)CN1C(=O)COc2ccccc21.Cc1cccc(C)c14.N34 |
44473 | COc1ccc(NC(=O)CN2C(=O)COc3ccccc32)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][C][=C][Ring2][Ring1][Branch1] | C4(=O)CN1C(=O)COc2ccccc21.c15ccc6cc1.CO5.N46 |
44474 | CCOc1ccc(NC(=O)CN2C(=O)COc3ccccc32)cc1 | [C][C][O][C][=C][C][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][C][=C][Ring2][Ring1][Branch1] | C4(=O)CN1C(=O)COc2ccccc21.c16ccc7cc1.CC5.O56.N47 |
44475 | CCOc1ccccc1NC(=O)CN1C(=O)COc2ccccc21 | [C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O] | C3(=O)CN1C(=O)COc2ccccc21.c15ccccc16.CC4.O45.N36 |
44476 | O=C(CN1C(=O)COc2ccccc21)Nc1ccccc1F | [O][=C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][F] | O=C3CN1C(=O)COc2ccccc21.c14ccccc1F.N34 |
44477 | CN(C(=O)CN1C(=O)COc2ccccc21)C1CCCCC1 | [C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][C][C][C][C][C][C][Ring1][=Branch1] | C3(=O)CN1C(=O)COc2ccccc21.C14CCCCC1.CN34 |
44478 | O=C(CN1C(=O)COc2ccccc21)Nc1nccs1 | [O][=C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][N][C][=N][C][=C][S][Ring1][Branch1] | O=C3CN1C(=O)COc2ccccc21.c14nccs1.N34 |
44479 | COc1ccc(NC(=O)CN2C(=O)COc3ccccc32)cc1OC | [C][O][C][=C][C][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][C][=C][Ring2][Ring1][Branch1][O][C] | C4(=O)CN1C(=O)COc2ccccc21.c15ccc7cc16.CO5.N47.O6C |
44480 | O=C1COc2ccccc2N1CC(=O)N(Cc1ccncc1)C1CC1 | [O][=C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][#Branch2][C][C][=Branch1][C][=O][N][Branch1][#Branch2][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][C][Ring1][Ring1] | O=C1COc2ccccc2N1CC3=O.c16ccncc1.N345.C15CC1.C46 |
44481 | O=C1COc2ccccc2N1CC(=O)N(Cc1cccnc1)C1CC1 | [O][=C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][#Branch2][C][C][=Branch1][C][=O][N][Branch1][#Branch2][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][C][Ring1][Ring1] | O=C1COc2ccccc2N1CC3=O.c16cccnc1.N345.C15CC1.C46 |
44482 | CC1Oc2ccccc2N(CC(=O)NC2CCCC2)C1=O | [C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][=C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][Ring1][=O] | CC1Oc2ccccc2N(CC3=O)C1=O.C14CCCC1.N34 |
44483 | CC1Oc2ccccc2N(CC(=O)N2CCc3ccccc32)C1=O | [C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][Ring2][Ring1][=Branch1][=O] | CC1Oc2ccccc2N(CC4=O)C1=O.N14CCc2ccccc21 |
44484 | CC1CCCN(C(=O)CN2C(=O)C(C)Oc3ccccc32)C1 | [C][C][C][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N][C][Ring2][Ring1][Branch1] | C4(=O)CN1C(=O)C(C)Oc2ccccc21.CC1CCCN4C1 |
44486 | COc1ccc(NC(=O)CN2C(=O)C(C)Oc3ccccc32)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][O][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N][C][=C][Ring2][Ring1][=Branch1] | C4(=O)CN1C(=O)C(C)Oc2ccccc21.c15ccc6cc1.CO5.N46 |
44487 | COc1ccc(C)cc1NC(=O)CN1C(=O)C(C)Oc2ccccc21 | [C][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N] | C3(=O)CN1C(=O)C(C)Oc2ccccc21.c14ccc(C)cc15.CO4.N35 |
44488 | CC1Oc2ccccc2N(CC(=O)Nc2ccc3c(c2)OCO3)C1=O | [C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C][Ring2][Ring1][#Branch1][=O] | CC1Oc2ccccc2N(CC4=O)C1=O.c15ccc2c(c1)OCO2.N45 |
44489 | CC(=O)c1ccc(NC(=O)CN2C(=O)C(C)Oc3ccccc32)cc1 | [C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][O][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N][C][=C][Ring2][Ring1][=Branch1] | C4(=O)CN1C(=O)C(C)Oc2ccccc21.c16ccc5cc1.CC6=O.N45 |
44490 | CC1Oc2ccccc2N(CC(=O)Nc2ccccc2F)C1=O | [C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][S][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][Ring2][Ring1][Branch1][=O] | CC1Oc2ccccc2N(CC3=O)C1=O.c14ccccc1F.N34 |
44491 | COc1ccccc1NC(=O)CN1C(=O)C(C)Oc2ccccc21 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N] | C3(=O)CN1C(=O)C(C)Oc2ccccc21.c14ccccc15.CO4.N35 |
44492 | CC1Oc2ccccc2N(CC(=O)Nc2ccc(F)cc2)C1=O | [C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring2][Ring1][Branch1][=O] | CC1Oc2ccccc2N(CC3=O)C1=O.c14ccc(F)cc1.N34 |
44493 | CC1Oc2ccccc2N(CC(=O)NC2CC2)C1=O | [C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][N][C][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][C][Ring1][P][=O] | CC1Oc2ccccc2N(CC3=O)C1=O.C14CC1.N34 |
44495 | CC1Oc2ccccc2N(CC(=O)NCc2ccccc2F)C1=O | [C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][P][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][Ring2][Ring1][=Branch1][=O] | CC1Oc2ccccc2N(CC3=O)C1=O.c15ccccc1F.N34.C45 |
44496 | COc1ccccc1CNC(=O)CN1C(=O)C(C)Oc2ccccc21 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N] | C3(=O)CN1C(=O)C(C)Oc2ccccc21.c14ccccc16.CO4.C56.N35 |
44497 | CCC1Oc2ccccc2N(CC(=O)Nc2ccccc2OC)C1=O | [C][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][P][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Ring2][Ring1][=Branch1][=O] | C16Oc2ccccc2N(CC3=O)C1=O.c15ccccc14.CC6.N35.O4C |
44498 | Cc1ccc2c(c1)N(CC(=O)N1CCc3ccccc31)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring2] | Cc1ccc2c(c1)N(CC4=O)C(=O)CO2.N14CCc2ccccc21 |
44500 | Cc1ccc2c(c1)N(CC(=O)N1CCCCC1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][=C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C][O][Ring1][P] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.N13CCCCC1 |
44501 | Cc1ccc2c(c1)N(CC(=O)N1CCCCC1C)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C][C][=Branch1][C][=O][C][O][Ring2][Ring1][C] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.N13CCCCC1C |
44502 | Cc1ccc2c(c1)N(CC(=O)N1CCCC(C)C1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][P][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][C] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.N13CCCC(C)C1 |
44503 | Cc1ccc2c(c1)N(CC(=O)N1CCC(C)CC1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][P][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][C] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.N13CCC(C)CC1 |
44504 | Cc1ccc2c(c1)N(CC(=O)N1C(C)CCCC1C)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][C][C][Ring1][#Branch1][C][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring1] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.N13C(C)CCCC1C |
44505 | Cc1ccc2c(c1)N(CC(=O)N1CCCc3ccccc31)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][=Branch1][C][=O][C][O][Ring2][Ring1][Branch1] | Cc1ccc2c(c1)N(CC4=O)C(=O)CO2.N14CCCc2ccccc21 |
44506 | COc1ccc(NC(=O)CN2C(=O)COc3ccc(C)cc32)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][O][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][Ring1][N][C][=C][Ring2][Ring1][=Branch1] | C4(=O)CN1C(=O)COc2ccc(C)cc21.c15ccc6cc1.CO5.N46 |
44507 | CCOc1ccccc1NC(=O)CN1C(=O)COc2ccc(C)cc21 | [C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][Ring1][N] | C3(=O)CN1C(=O)COc2ccc(C)cc21.c15ccccc16.CC4.O45.N36 |
44508 | COc1ccc(C)cc1NC(=O)CN1C(=O)COc2ccc(C)cc21 | [C][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][Ring1][N] | C3(=O)CN1C(=O)COc2ccc(C)cc21.c14ccc(C)cc15.CO4.N35 |
44509 | Cc1ccc2c(c1)N(CC(=O)Nc1ccccc1F)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][S][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring1] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.c14ccccc1F.N34 |
44510 | Cc1ccc2c(c1)N(CC(=O)Nc1ccc(F)cc1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring1] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.c14ccc(F)cc1.N34 |
44511 | Cc1ccc2c(c1)N(CC(=O)N1CCC(O)CC1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][P][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][O][C][C][Ring1][#Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][C] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.N13CCC(O)CC1 |
44512 | Cc1ccc2c(c1)N(CC(=O)N(C)C1CCCCC1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring1] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.C14CCCCC1.N34C |
44513 | Cc1ccc2c(c1)N(CC(=O)NCc1cccs1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][S][Ring1][Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][C] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.c15cccs1.N34.C45 |
44514 | COc1ccc(CNC(=O)CN2C(=O)COc3ccc(C)cc32)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][N][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][Ring1][N][C][=C][Ring2][Ring1][#Branch1] | C4(=O)CN1C(=O)COc2ccc(C)cc21.c15ccc7cc1.CO5.C67.N46 |
44515 | Cc1ccc2c(c1)N(CC(=O)NCc1ccccc1F)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][P][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring2] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.c15ccccc1F.N34.C45 |
44516 | Cc1ccc2c(c1)N(CC(=O)NCc1ccc(Cl)cc1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring2] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.c15ccc(Cl)cc1.N34.C45 |
44517 | Cc1ccc2c(c1)N(CC(=O)NC1CCCC1)C(=O)C(C)O2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][=C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][C][O][Ring2][Ring1][C] | Cc1ccc2c(c1)N(CC3=O)C(=O)C(C)O2.C14CCCC1.N34 |
44518 | Cc1ccc2c(c1)N(CC(=O)N1CCCC1)C(=O)C(C)O2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][=N][C][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][C][O][Ring1][P] | Cc1ccc2c(c1)N(CC3=O)C(=O)C(C)O2.N13CCCC1 |
44519 | Cc1ccc2c(c1)N(CC(=O)N1CCCCC1)C(=O)C(C)O2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][=C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][C][C][O][Ring2][Ring1][C] | Cc1ccc2c(c1)N(CC3=O)C(=O)C(C)O2.N13CCCCC1 |
44520 | Cc1ccc2c(c1)N(CC(=O)N1CCCC(C)C1)C(=O)C(C)O2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][P][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][C][C][O][Ring2][Ring1][Ring1] | Cc1ccc2c(c1)N(CC3=O)C(=O)C(C)O2.N13CCCC(C)C1 |
44521 | Cc1ccc2c(c1)N(CC(=O)NCc1ccccc1)C(=O)C(C)O2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][S][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][C][C][O][Ring2][Ring1][Ring2] | Cc1ccc2c(c1)N(CC3=O)C(=O)C(C)O2.c15ccccc1.N34.C45 |
44522 | Cc1ccc2c(c1)N(CC(=O)Nc1ccccc1F)C(=O)C(C)O2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][S][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=Branch1][C][=O][C][Branch1][C][C][O][Ring2][Ring1][Ring2] | Cc1ccc2c(c1)N(CC3=O)C(=O)C(C)O2.c14ccccc1F.N34 |
44523 | Cc1ccc2c(c1)N(CC(=O)Nc1ccc(F)cc1)C(=O)C(C)O2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][C][C][O][Ring2][Ring1][Ring2] | Cc1ccc2c(c1)N(CC3=O)C(=O)C(C)O2.c14ccc(F)cc1.N34 |
44524 | Cc1ccc2c(c1)N(CC(=O)NCc1cccs1)C(=O)C(C)O2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][S][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][C][O][Ring2][Ring1][Ring1] | Cc1ccc2c(c1)N(CC3=O)C(=O)C(C)O2.c15cccs1.N34.C45 |
44525 | Cc1ccc2c(c1)N(CC(=O)NCc1ccc(F)cc1)C(=O)C(C)O2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][C][C][O][Ring2][Ring1][Branch1] | Cc1ccc2c(c1)N(CC3=O)C(=O)C(C)O2.c15ccc(F)cc1.N34.C45 |
44526 | CCCn1c(SCC(=O)NC2CCCC2)nnc1-c1cccnc1 | [C][C][C][N][C][Branch1][#C][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][=N][N][=C][Ring1][#C][C][=C][C][=C][N][=C][Ring1][=Branch1] | n16c7nnc18.c18cccnc1.C15CCCC1.C4C3=O.CCC6.S47.N35 |
44527 | COc1cccc(-c2noc(C3CCCN(C(=O)CC(C)C)C3)n2)c1 | [C][O][C][=C][C][=C][C][Branch2][Ring1][#C][C][=N][O][C][Branch2][Ring1][Branch1][C][C][C][C][N][Branch1][O][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][Ring1][N][=N][Ring1][P][=C][Ring2][Ring1][#Branch1] | c15cccc7c1.C16CCCN4C1.c17noc6n1.C4(=O)CC(C)C.CO5 |
44528 | CCCn1c(SCC(=O)N2CCCCC2)nnc1-c1ccccn1 | [C][C][C][N][C][Branch1][#C][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][=N][N][=C][Ring1][#C][C][=C][C][=C][C][=N][Ring1][=Branch1] | n15c6nnc17.N13CCCCC1.c17ccccn1.C4C3=O.CCC5.S46 |
44529 | CCCC(=O)N1CCCC(c2nc(-c3ccc(OC)cc3)no2)C1 | [C][C][C][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][=Branch1][C][=N][C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][=N][O][Ring1][=N][C][Ring2][Ring1][Ring1] | N14CCCC6C1.c17ccc5cc1.c16nc7no1.CCCC4=O.O5C |
44530 | CCCn1c(SCC(=O)NC2CC2)nnc1-c1ccccn1 | [C][C][C][N][C][Branch1][=N][S][C][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][=N][N][=C][Ring1][=N][C][=C][C][=C][C][=N][Ring1][=Branch1] | n16c7nnc18.c18ccccn1.C4C3=O.CCC6.C15CC1.S47.N35 |
44531 | CC(=O)Nc1ccc2nc(C3CC3)n(Cc3ccccc3)c(=O)c2c1 | [C][C][=Branch1][C][=O][N][C][=C][C][=C][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][P][=C][Ring2][Ring1][Branch1] | c15ccc2nc8n6c(=O)c2c1.c17ccccc1.CC4=O.C18CC1.N45.C67 |
44532 | CCC(=O)Nc1ccc2nc(C3CC3)n(Cc3ccccc3)c(=O)c2c1 | [C][C][C][=Branch1][C][=O][N][C][=C][C][=C][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][P][=C][Ring2][Ring1][Branch1] | c15ccc2nc8n6c(=O)c2c1.c17ccccc1.CCC4=O.C18CC1.N45.C67 |
44533 | CCC(=O)Nc1ccc2nc(C)n(Cc3ccc(F)cc3)c(=O)c2c1 | [C][C][C][=Branch1][C][=O][N][C][=C][C][=C][N][=C][Branch1][C][C][N][Branch1][=N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][Ring1][S][=C][Ring2][Ring1][Ring2] | c15ccc2nc(C)n6c(=O)c2c1.c17ccc(F)cc1.CCC4=O.N45.C67 |
44534 | CCc1nc2ccc(NC(C)=O)cc2c(=O)n1Cc1ccc(F)cc1 | [C][C][C][=N][C][=C][C][=C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][N][Ring1][#C][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1] | c16nc2ccc4cc2c(=O)n15.c17ccc(F)cc1.C3(C)=O.CC6.N34.C57 |
44535 | Cc1ccc(Cn2c(C3CC3)nc3ccc(N)cc3c2=O)cc1 | [C][C][=C][C][=C][Branch2][Ring1][O][C][N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][Ring1][=C][=O][C][=C][Ring2][Ring1][=Branch1] | n14c6nc2ccc(N)cc2c1=O.Cc1ccc5cc1.C16CC1.C45 |
44536 | Nc1ccc2nc(C3CC3)n(Cc3ccc(Cl)cc3)c(=O)c2c1 | [N][C][=C][C][=C][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][=N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][Ring2][Ring1][C][=C][Ring2][Ring1][=Branch1] | Nc1ccc2nc6n4c(=O)c2c1.c15ccc(Cl)cc1.C16CC1.C45 |
44537 | CCC(C)C(=O)N1CCCC(c2nc(-c3cccs3)no2)C1 | [C][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][P][C][=N][C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][=N][O][Ring1][#Branch2][C][Ring1][S] | N14CCCC6C1.CCC(C)C4=O.c16nc5no1.c15cccs1 |
44538 | O=C(c1ccco1)N1CCCC(c2nc(-c3cccs3)no2)C1 | [O][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][N][C][C][C][C][Branch1][P][C][=N][C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][=N][O][Ring1][#Branch2][C][Ring1][S] | N14CCCC7C1.c17nc6no1.c15ccco1.c16cccs1.O=C45 |
44539 | CCCC(=O)N1CCCC(c2nc(-c3cccs3)no2)C1 | [C][C][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][P][C][=N][C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][=N][O][Ring1][#Branch2][C][Ring1][S] | N14CCCC6C1.c16nc5no1.CCCC4=O.c15cccs1 |
44540 | Cc1ccc(-c2noc(C3CCCN(C(=O)c4ccccc4)C3)n2)o1 | [C][C][=C][C][=C][Branch2][Ring2][C][C][=N][O][C][Branch2][Ring1][#Branch1][C][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=C][=N][Ring2][Ring1][Ring1][O][Ring2][Ring1][Branch2] | C18CCCN5C1.Cc1ccc7o1.c17noc8n1.c16ccccc1.C56=O |
44541 | NC(=O)CSc1nnc2n(Cc3ccccc3)c3ccccc3n12 | [N][C][=Branch1][C][=O][C][S][C][=N][N][=C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring2][Ring1][Ring1][Ring1][S] | c17nnc2n5c3ccccc3n12.c16ccccc1.NC(=O)C4.S47.C56 |
44542 | Cc1cccc(C(=O)N(Cc2cc3cc(C)ccc3[nH]c2=O)C2CC2)c1 | [C][C][=C][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][Branch2][Ring1][Ring2][C][C][=C][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][NH1][C][Ring1][O][=O][C][C][C][Ring1][Ring1][=C][Ring2][Ring1][=Branch2] | c18cc2cc(C)ccc2[nH]c1=O.Cc1cccc7c1.C47=O.N456.C16CC1.C58 |
44543 | CCC(=O)Nn1c(C2CCC2)nc2ccccc2c1=O | [C][C][C][=Branch1][C][=O][N][N][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=C][=O] | CCC(=O)Nn1c3nc2ccccc2c1=O.C13CCC1 |
44544 | CCC(C)C(=O)Nn1c(C2CC2)nc2cc(OC)c(OC)cc2c1=O | [C][C][C][Branch1][C][C][C][=Branch1][C][=O][N][N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][#Branch2][C][Ring1][P][=O] | CCC(C)C(=O)Nn1c5nc2cc3c4cc2c1=O.C15CC1.O3C.O4C |
44545 | COc1cc2nc(C3CCC3)n(NC(=O)C(C)C)c(=O)c2cc1OC | [C][O][C][=C][C][N][=C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][N][Branch1][O][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][=Branch1][C][=O][C][=Ring1][P][C][=C][Ring2][Ring1][Branch1][O][C] | c14cc2nc6n(NC(=O)C(C)C)c(=O)c2cc15.C16CCC1.CO4.O5C |
44546 | Cc1cc(C)n2c(SCC(=O)N(C)C3CCCCC3)nnc2n1 | [C][C][C][=C][Branch1][C][C][N][C][Branch2][Ring1][Ring1][S][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][C][C][Ring1][=Branch1][=N][N][=C][Ring1][P][N][=Ring2][Ring1][=Branch1] | Cc1cc(C)n2c7nnc2n1.C16CCCCC1.C5C4=O.N46C.S57 |
44547 | Cc1cc(C)n2c(SCC(=O)NC3CCCCC3)nnc2n1 | [C][C][C][=C][Branch1][C][C][N][C][Branch1][S][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1][=N][N][=C][Ring1][S][N][=Ring2][Ring1][Branch1] | Cc1cc(C)n2c7nnc2n1.C16CCCCC1.C5C4=O.S57.N46 |
44548 | Cc1c(Cl)cccc1NC(=O)CSc1nnc2ncccn12 | [C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][N][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1] | c16nnc2ncccn12.Cc1c5cccc1Cl.C3(=O)C4.N35.S46 |
44549 | O=C(CSc1nnc2ncccn12)Nc1ccccc1F | [O][=C][Branch1][S][C][S][C][=N][N][=C][N][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][F] | c16nnc2ncccn12.c15ccccc1F.O=C3C4.S46.N35 |
44551 | O=C(CSc1nnc2ncccn12)Nc1nccs1 | [O][=C][Branch1][S][C][S][C][=N][N][=C][N][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1][N][C][=N][C][=C][S][Ring1][Branch1] | c16nnc2ncccn12.c15nccs1.O=C3C4.S46.N35 |
44552 | O=C(CSc1nnc2ncccn12)NCc1cccs1 | [O][=C][Branch1][S][C][S][C][=N][N][=C][N][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1][N][C][C][=C][C][=C][S][Ring1][Branch1] | c17nnc2ncccn12.c16cccs1.O=C3C5.S57.N34.C46 |
44553 | O=C1CN(C(=O)CSc2nnc3ncccn23)c2ccccc2N1 | [O][=C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][S][C][=N][N][=C][N][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring2][Ring1][#Branch1] | O=C1CN4c2ccccc2N1.c16nnc2ncccn12.C4(=O)C5.S56 |
44554 | Cc1csc(NC(=O)CSc2nnc3ncccn23)n1 | [C][C][=C][S][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][N][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1][=N][Ring2][Ring1][Ring1] | c17nnc2ncccn12.Cc1csc6n1.C4(=O)C5.N46.S57 |
44556 | CC(=O)N1c2ccc(-c3csc(NC(=O)C4CC4)n3)cc2CC1C | [C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][Ring2][C][=C][S][C][Branch1][O][N][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][=N][Ring1][O][C][=C][Ring1][P][C][C][Ring2][Ring1][Ring2][C] | N15c2ccc9cc2CC1C.c19csc7n1.CC5=O.C68=O.C18CC1.N67 |
44557 | CC(C)CNC(=O)C1CCN(C(=O)NC2CCCCC2)CC1 | [C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][#C] | C18CCN4CC1.C17CCCCC1.CC(C)C6.C38=O.C45=O.N36.N57 |
44558 | O=C(NCc1cccnc1)C1CCN(C(=O)NC2CCCCC2)CC1 | [O][=C][Branch1][O][N][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][#C] | C18CCN4CC1.c19cccnc1.C17CCCCC1.O=C38.C45=O.N36.C69.N57 |
44559 | CC(=O)Nc1nc(-c2ccc3c(c2)CCN3S(C)(=O)=O)cs1 | [C][C][=Branch1][C][=O][N][C][=N][C][Branch2][Ring1][Branch2][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][N][Ring1][=Branch1][S][Branch1][C][C][=Branch1][C][=O][=O][=C][S][Ring2][Ring1][C] | c17ccc2c(c1)CCN25.c16nc7cs1.S5(C)(=O)=O.CC4=O.N46 |
44560 | CC(C)NC(=O)CSc1nnc2c(n1)[nH]c1ccccc12 | [C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2] | c16nnc2c(n1)[nH]c1ccccc12.C3(=O)C5.CC4C.N34.S56 |
44561 | CCOC(=O)C(C)Sc1nnc2c(n1)[nH]c1ccc(C)cc12 | [C][C][O][C][=Branch1][C][=O][C][Branch1][C][C][S][C][=N][N][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][NH1][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][Ring1][O] | c16nnc2c(n1)[nH]c1ccc(C)cc12.C3(=O)C5C.CC4.O34.S56 |
44562 | Cc1ccc2c(c1)c1nnc(SCC(N)=O)nc1n2C | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=N][N][=C][Branch1][Branch2][S][C][C][Branch1][C][N][=O][N][=C][Ring1][O][N][Ring1][#C][C] | Cc1ccc2c(c1)c1nnc4nc1n2C.C3C(N)=O.S34 |
44563 | CCN(CC)C(=O)CSc1nnc2c3cc(C)ccc3n(C)c2n1 | [C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][S][C][=N][N][=C][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][N][Branch1][C][C][C][Ring1][O][=N][Ring1][#C] | c18nnc2c3cc(C)ccc3n(C)c2n1.C4(=O)C7.N456.CC5.C6C.S78 |
44564 | Cc1ccc2c(c1)c1nnc(SCC(=O)N3CCCC3)nc1n2C | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=N][N][=C][Branch1][=C][S][C][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][N][=C][Ring1][#C][N][Ring2][Ring1][Ring1][C] | Cc1ccc2c(c1)c1nnc6nc1n2C.N14CCCC1.C5C4=O.S56 |
44565 | Cc1ccc2c(c1)c1nnc(SCC(=O)NC(C)C)nc1n2C | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=N][N][=C][Branch1][=N][S][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][=C][Ring1][=C][N][Ring2][Ring1][C][C] | Cc1ccc2c(c1)c1nnc6nc1n2C.C5C3=O.C4(C)C.S56.N34 |
44566 | Cc1ccc2c(c1)c1nnc(SCC(=O)NC(C)(C)C)nc1n2C | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=N][N][=C][Branch1][S][S][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][N][=C][Ring1][#C][N][Ring2][Ring1][Ring1][C] | Cc1ccc2c(c1)c1nnc6nc1n2C.C5C3=O.C4(C)(C)C.S56.N34 |
44567 | CCc1ccc2c(c1)c1nnc(SCC(=O)NC3CC3)nc1n2C | [C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=N][N][=C][Branch1][=N][S][C][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][N][=C][Ring1][=C][N][Ring2][Ring1][C][C] | c17ccc2c(c1)c1nnc8nc1n2C.C5C4=O.C16CC1.CC7.S58.N46 |
44568 | COc1ccc2c(c1)c1nnc(SCC(=O)NC3CC3)nc1n2C | [C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=N][N][=C][Branch1][=N][S][C][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][N][=C][Ring1][=C][N][Ring2][Ring1][C][C] | c15ccc2c(c1)c1nnc8nc1n2C.C6C4=O.C17CC1.CO5.S68.N47 |
44569 | COc1ccc2c(c1)c1nnc(SCC(=O)NC(C)C)nc1n2C | [C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=N][N][=C][Branch1][=N][S][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][=C][Ring1][=C][N][Ring2][Ring1][C][C] | c14ccc2c(c1)c1nnc7nc1n2C.C6C3=O.C5(C)C.CO4.S67.N35 |
44570 | CCOc1ccc2c(c1)c1nnc(SCC3CCCO3)nc1n2C | [C][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=N][N][=C][Branch1][#Branch2][S][C][C][C][C][C][O][Ring1][Branch1][N][=C][Ring1][=N][N][Ring1][P][C] | c15ccc2c(c1)c1nnc8nc1n2C.C17CCCO1.CC4.O45.S68.C67 |
44571 | Fc1ccc2[nH]c3nc(SCc4ccccc4F)nnc3c2c1 | [F][C][=C][C][=C][NH1][C][=N][C][Branch1][N][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][=N][N][=C][Ring1][#C][C][Ring2][Ring1][C][=C][Ring2][Ring1][=Branch1] | Fc1ccc2[nH]c3nc7nnc3c2c1.c16ccccc1F.S57.C56 |
44572 | CCOC(=O)C(C)Sc1nnc2c(n1)[nH]c1ccc(F)cc12 | [C][C][O][C][=Branch1][C][=O][C][Branch1][C][C][S][C][=N][N][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring1][O] | c16nnc2c(n1)[nH]c1ccc(F)cc12.C3(=O)C5C.CC4.O34.S56 |
44573 | CCOC(=O)C(CC)Sc1nnc2c(n1)[nH]c1ccc(F)cc12 | [C][C][O][C][=Branch1][C][=O][C][Branch1][Ring1][C][C][S][C][=N][N][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring1][O] | c16nnc2c(n1)[nH]c1ccc(F)cc12.C3(=O)C5CC.CC4.O34.S56 |
44574 | CC(C)NC(=O)CSc1nnc2c(n1)[nH]c1ccc(F)cc12 | [C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring1][O] | c16nnc2c(n1)[nH]c1ccc(F)cc12.C3(=O)C5.CC4C.N34.S56 |
44575 | Cn1c2ccc(F)cc2c2nnc(SCc3ccc(F)cc3)nc21 | [C][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=N][N][=C][Branch1][=C][S][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][=C][Ring1][#C][Ring2][Ring1][#Branch1] | Cn1c2ccc(F)cc2c2nnc6nc21.c15ccc(F)cc1.S46.C45 |
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