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

Systemtic Name: 7-(4-methoxyphenoxy)-4-(4-methylphenyl)-2-methylsulfanyl-3H-1,5-benzodiazepine Openeye Name: 7-(4-methoxyphenoxy)-2-methylsulfanyl-4-(p-tolyl)-3H-1,5-benzodiazepine CAS Name: 7-(4-methoxyphenoxy)-4-(4-methylphenyl)-2-(methylthio)-3H-1,5-benzodiazepine IUPAC Name: 7-(4-methoxyphenoxy)-4-(4-methylphenyl)-2-methylsulfanyl-3H-1,5-benzodiazepine Traditional Name: 7-(4-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=C(C=C4)OC)N=C(C2)SC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)OC4=CC=C(C=C4)OC)N=C(C2)SC

InChI

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