4-(4-chlorophenyl)-7-(3-methylphenoxy)-1,3-dihydro-1,5-benzodiazepine-2-thione

Systemtic Name: 4-(4-chlorophenyl)-7-(3-methylphenoxy)-1,3-dihydro-1,5-benzodiazepine-2-thione Openeye Name: 4-(4-chlorophenyl)-7-(3-methylphenoxy)-1,3-dihydro-1,5-benzodiazepine-2-thione CAS Name: 4-(4-chlorophenyl)-7-(3-methylphenoxy)-1,3-dihydro-1,5-benzodiazepine-2-thione IUPAC Name: 4-(4-chlorophenyl)-7-(3-methylphenoxy)-1,3-dihydro-1,5-benzodiazepine-2-thione Traditional Name: 4-(4-chlorophenyl)-7-(3-methylphenoxy)-1,3-dihydro-1,5-benzodiazepine-2-thione Formula: C22H17ClN2OS MolecularWeight: 392.90118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC3=C(C=C2)NC(=S)CC(=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC3=C(C=C2)NC(=S)CC(=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClN2OS/c1-14-3-2-4-17(11-14)26-18-9-10-19-21(12-18)24-20(13-22(27)25-19)15-5-7-16(23)8-6-15/h2-12H,13H2,1H3,(H,25,27)