6-(4-methylpiperazin-1-yl)-3-methylsulfanyl-5H-benzo[b][1,4]benzodiazepine

Systemtic Name: 6-(4-methylpiperazin-1-yl)-3-methylsulfanyl-5H-benzo[b][1,4]benzodiazepine Openeye Name: 6-(4-methylpiperazin-1-yl)-3-methylsulfanyl-5H-benzo[b][1,4]benzodiazepine CAS Name: 6-(4-methyl-1-piperazinyl)-3-(methylthio)-5H-benzo[b][1,4]benzodiazepine IUPAC Name: 6-(4-methylpiperazin-1-yl)-3-methylsulfanyl-5H-benzo[b][1,4]benzodiazepine Traditional Name: 6-(4-methylpiperazino)-3-(methylthio)-5H-benzo[b][1,4]benzodiazepine Formula: C19H22N4S MolecularWeight: 338.46978

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)SC

Isomeric SMILES

CN1CCN(CC1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)SC

InChI

InChI=1S/C19H22N4S/c1-22-9-11-23(12-10-22)19-15-5-3-4-6-16(15)20-17-8-7-14(24-2)13-18(17)21-19/h3-8,13,21H,9-12H2,1-2H3