4-(4-methylphenyl)-7-phenylsulfanyl-1,3-dihydro-1,5-benzodiazepine-2-thione

Systemtic Name: 4-(4-methylphenyl)-7-phenylsulfanyl-1,3-dihydro-1,5-benzodiazepine-2-thione Openeye Name: 7-phenylsulfanyl-4-(p-tolyl)-1,3-dihydro-1,5-benzodiazepine-2-thione CAS Name: 4-(4-methylphenyl)-7-(phenylthio)-1,3-dihydro-1,5-benzodiazepine-2-thione IUPAC Name: 4-(4-methylphenyl)-7-phenylsulfanyl-1,3-dihydro-1,5-benzodiazepine-2-thione Traditional Name: 7-(phenylthio)-4-(p-tolyl)-1,3-dihydro-1,5-benzodiazepine-2-thione Formula: C22H18N2S2 MolecularWeight: 374.52172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)SC4=CC=CC=C4)NC(=S)C2

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)SC4=CC=CC=C4)NC(=S)C2

InChI

InChI=1S/C22H18N2S2/c1-15-7-9-16(10-8-15)20-14-22(25)24-19-12-11-18(13-21(19)23-20)26-17-5-3-2-4-6-17/h2-13H,14H2,1H3,(H,24,25)