(3E)-5-(4-methylpentan-2-yl)-1-phenyl-3-(phenylhydrazinylidene)-1,5-benzodiazepine-2,4-dione

Systemtic Name: (3E)-5-(4-methylpentan-2-yl)-1-phenyl-3-(phenylhydrazinylidene)-1,5-benzodiazepine-2,4-dione Openeye Name: (3E)-5-(1,3-dimethylbutyl)-1-phenyl-3-(phenylhydrazono)-1,5-benzodiazepine-2,4-dione CAS Name: (3E)-5-(4-methylpentan-2-yl)-1-phenyl-3-(phenylhydrazinylidene)-1,5-benzodiazepine-2,4-dione IUPAC Name: (3E)-5-(4-methylpentan-2-yl)-1-phenyl-3-(phenylhydrazinylidene)-1,5-benzodiazepine-2,4-dione Traditional Name: (3E)-5-(1,3-dimethylbutyl)-1-phenyl-3-(phenylhydrazono)-1,5-benzodiazepine-2,4-quinone Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)N1C2=CC=CC=C2N(C(=O)C(=NNC3=CC=CC=C3)C1=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC(C)N1C2=CC=CC=C2N(C(=O)/C(=N/NC3=CC=CC=C3)/C1=O)C4=CC=CC=C4

InChI

InChI=1S/C27H28N4O2/c1-19(2)18-20(3)30-23-16-10-11-17-24(23)31(22-14-8-5-9-15-22)27(33)25(26(30)32)29-28-21-12-6-4-7-13-21/h4-17,19-20,28H,18H2,1-3H3/b29-25+