4-(phenylcarbonyl)-3-(phenylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile

Systemtic Name: 4-(phenylcarbonyl)-3-(phenylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile Openeye Name: 4-benzoyl-3-benzyl-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile CAS Name: 4-benzoyl-3-(phenylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile IUPAC Name: 4-benzoyl-3-benzyl-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile Traditional Name: 4-benzoyl-3-benzyl-1,2,3,5-tetrahydro-1,4-benzodiazepine-7-carbonitrile Formula: C24H21N3O MolecularWeight: 367.44304

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=C(N1)C=CC(=C2)C#N)C(=O)C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1C(N(CC2=C(N1)C=CC(=C2)C#N)C(=O)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H21N3O/c25-15-19-11-12-23-21(13-19)17-27(24(28)20-9-5-2-6-10-20)22(16-26-23)14-18-7-3-1-4-8-18/h1-13,22,26H,14,16-17H2