3-(4-chlorophenyl)-1,2-dimethyl-5-oxidanylidene-7-phenyl-3,4-dihydro-1,2-diazepine-6-carbonitrile

Systemtic Name: 3-(4-chlorophenyl)-1,2-dimethyl-5-oxidanylidene-7-phenyl-3,4-dihydro-1,2-diazepine-6-carbonitrile Openeye Name: 3-(4-chlorophenyl)-1,2-dimethyl-5-oxo-7-phenyl-3,4-dihydrodiazepine-6-carbonitrile CAS Name: 3-(4-chlorophenyl)-1,2-dimethyl-5-oxo-7-phenyl-3,4-dihydrodiazepine-6-carbonitrile IUPAC Name: 3-(4-chlorophenyl)-1,2-dimethyl-5-oxo-7-phenyl-3,4-dihydrodiazepine-6-carbonitrile Traditional Name: 3-(4-chlorophenyl)-5-keto-1,2-dimethyl-7-phenyl-3,4-dihydrodiazepine-6-carbonitrile Formula: C20H18ClN3O MolecularWeight: 351.82942

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CC(=O)C(=C(N1C)C2=CC=CC=C2)C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C(CC(=O)C(=C(N1C)C2=CC=CC=C2)C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClN3O/c1-23-18(14-8-10-16(21)11-9-14)12-19(25)17(13-22)20(24(23)2)15-6-4-3-5-7-15/h3-11,18H,12H2,1-2H3