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

Systemtic Name: 7-(2-methoxyphenoxy)-4-(4-methylphenyl)-2-methylsulfanyl-3H-1,5-benzodiazepine Openeye Name: 7-(2-methoxyphenoxy)-2-methylsulfanyl-4-(p-tolyl)-3H-1,5-benzodiazepine CAS Name: 7-(2-methoxyphenoxy)-4-(4-methylphenyl)-2-(methylthio)-3H-1,5-benzodiazepine IUPAC Name: 7-(2-methoxyphenoxy)-4-(4-methylphenyl)-2-methylsulfanyl-3H-1,5-benzodiazepine Traditional Name: 7-(2-methoxyphenoxy)-2-(methylthio)-4-(p-tolyl)-3H-1,5-benzodiazepine Formula: C24H22N2O2S MolecularWeight: 402.50868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)OC4=CC=CC=C4OC)N=C(C2)SC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)OC4=CC=CC=C4OC)N=C(C2)SC

InChI

InChI=1S/C24H22N2O2S/c1-16-8-10-17(11-9-16)20-15-24(29-3)26-19-13-12-18(14-21(19)25-20)28-23-7-5-4-6-22(23)27-2/h4-14H,15H2,1-3H3