1-(3-fluorophenyl)carbonyl-N-methyl-N-[2-(methylamino)ethyl]-4-oxidanylidene-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide

Systemtic Name: 1-(3-fluorophenyl)carbonyl-N-methyl-N-[2-(methylamino)ethyl]-4-oxidanylidene-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: 1-(3-fluorobenzoyl)-N-methyl-N-[2-(methylamino)ethyl]-4-oxo-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: 1-[(3-fluorophenyl)-oxomethyl]-N-methyl-N-[2-(methylamino)ethyl]-4-oxo-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: 1-(3-fluorobenzoyl)-N-methyl-N-[2-(methylamino)ethyl]-4-oxo-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: 1-(3-fluorobenzoyl)-4-keto-N-methyl-N-[2-(methylamino)ethyl]-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C27H27FN4O3 MolecularWeight: 474.526683

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Descriptors Computed from Structure

Canonical SMILES:

CNCCN(C)C(=O)C1=CC2=C(C=C1)N(C(CC(=O)N2)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

CNCCN(C)C(=O)C1=CC2=C(C=C1)N(C(CC(=O)N2)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C27H27FN4O3/c1-29-13-14-31(2)26(34)20-11-12-23-22(16-20)30-25(33)17-24(18-7-4-3-5-8-18)32(23)27(35)19-9-6-10-21(28)15-19/h3-12,15-16,24,29H,13-14,17H2,1-2H3,(H,30,33)