6-methyl-12-(4-methylpiperazin-1-yl)-[1]benzothiolo[2,3-b][1,5]benzodiazepine

Systemtic Name: 6-methyl-12-(4-methylpiperazin-1-yl)-[1]benzothiolo[2,3-b][1,5]benzodiazepine Openeye Name: 6-methyl-12-(4-methylpiperazin-1-yl)benzothiopheno[2,3-b][1,5]benzodiazepine CAS Name: 6-methyl-12-(4-methyl-1-piperazinyl)-[1]benzothiolo[2,3-b][1,5]benzodiazepine IUPAC Name: 6-methyl-12-(4-methylpiperazin-1-yl)-[1]benzothiolo[2,3-b][1,5]benzodiazepine Traditional Name: 6-methyl-12-(4-methylpiperazino)benzothiopheno[2,3-b][1,5]benzodiazepine Formula: C21H22N4S MolecularWeight: 362.49118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3N(C4=C2C5=CC=CC=C5S4)C

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3N(C4=C2C5=CC=CC=C5S4)C

InChI

InChI=1S/C21H22N4S/c1-23-11-13-25(14-12-23)20-19-15-7-3-6-10-18(15)26-21(19)24(2)17-9-5-4-8-16(17)22-20/h3-10H,11-14H2,1-2H3