1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepine-7-carbonitrile

Systemtic Name: 1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepine-7-carbonitrile Openeye Name: 1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepine-7-carbonitrile CAS Name: 1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepine-7-carbonitrile IUPAC Name: 1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepine-7-carbonitrile Traditional Name: 2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepine-7-carbonitrile Formula: C17H13N3O MolecularWeight: 275.30462

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN=C(C2=C1C=CC(=C2)C#N)C3=CC=CC=C3

Isomeric SMILES

CN1C(=O)CN=C(C2=C1C=CC(=C2)C#N)C3=CC=CC=C3

InChI

InChI=1S/C17H13N3O/c1-20-15-8-7-12(10-18)9-14(15)17(19-11-16(20)21)13-5-3-2-4-6-13/h2-9H,11H2,1H3