(3E)-7-fluoranyl-5-(3-methylbutyl)-1-phenyl-3-(phenylhydrazinylidene)-1,5-benzodiazepine-2,4-dione

Systemtic Name: (3E)-7-fluoranyl-5-(3-methylbutyl)-1-phenyl-3-(phenylhydrazinylidene)-1,5-benzodiazepine-2,4-dione Openeye Name: (3E)-7-fluoro-5-isopentyl-1-phenyl-3-(phenylhydrazono)-1,5-benzodiazepine-2,4-dione CAS Name: (3E)-7-fluoro-5-(3-methylbutyl)-1-phenyl-3-(phenylhydrazinylidene)-1,5-benzodiazepine-2,4-dione IUPAC Name: (3E)-7-fluoro-5-(3-methylbutyl)-1-phenyl-3-(phenylhydrazinylidene)-1,5-benzodiazepine-2,4-dione Traditional Name: (3E)-7-fluoro-5-isoamyl-1-phenyl-3-(phenylhydrazono)-1,5-benzodiazepine-2,4-quinone Formula: C26H25FN4O2 MolecularWeight: 444.500703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=C(C=CC(=C2)F)N(C(=O)C(=NNC3=CC=CC=C3)C1=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)CCN1C2=C(C=CC(=C2)F)N(C(=O)/C(=N/NC3=CC=CC=C3)/C1=O)C4=CC=CC=C4

InChI

InChI=1S/C26H25FN4O2/c1-18(2)15-16-30-23-17-19(27)13-14-22(23)31(21-11-7-4-8-12-21)26(33)24(25(30)32)29-28-20-9-5-3-6-10-20/h3-14,17-18,28H,15-16H2,1-2H3/b29-24+