7-methyl-5-(4-methylphenyl)-2-methylsulfanyl-4,5-dihydro-1H-1,3-benzodiazepine

Systemtic Name: 7-methyl-5-(4-methylphenyl)-2-methylsulfanyl-4,5-dihydro-1H-1,3-benzodiazepine Openeye Name: 7-methyl-2-methylsulfanyl-5-(p-tolyl)-4,5-dihydro-1H-1,3-benzodiazepine CAS Name: 7-methyl-5-(4-methylphenyl)-2-(methylthio)-4,5-dihydro-1H-1,3-benzodiazepine IUPAC Name: 7-methyl-5-(4-methylphenyl)-2-methylsulfanyl-4,5-dihydro-1H-1,3-benzodiazepine Traditional Name: 7-methyl-2-(methylthio)-5-(p-tolyl)-4,5-dihydro-1H-1,3-benzodiazepine Formula: C18H20N2S MolecularWeight: 296.4298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CN=C(NC3=C2C=C(C=C3)C)SC

Isomeric SMILES

CC1=CC=C(C=C1)C2CN=C(NC3=C2C=C(C=C3)C)SC

InChI

InChI=1S/C18H20N2S/c1-12-4-7-14(8-5-12)16-11-19-18(21-3)20-17-9-6-13(2)10-15(16)17/h4-10,16H,11H2,1-3H3,(H,19,20)