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

Systemtic Name: N-methyl-N-[2-(methylamino)ethyl]-1-(4-methylphenyl)carbonyl-4-oxidanylidene-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-methyl-N-[2-(methylamino)ethyl]-1-(4-methylbenzoyl)-4-oxo-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-methyl-N-[2-(methylamino)ethyl]-1-[(4-methylphenyl)-oxomethyl]-4-oxo-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-methyl-N-[2-(methylamino)ethyl]-1-(4-methylbenzoyl)-4-oxo-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: 4-keto-N-methyl-N-[2-(methylamino)ethyl]-2-phenyl-1-p-toluoyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C28H30N4O3 MolecularWeight: 470.5628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)N(C)CCNC)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)N(C)CCNC)C4=CC=CC=C4

InChI

InChI=1S/C28H30N4O3/c1-19-9-11-21(12-10-19)28(35)32-24-14-13-22(27(34)31(3)16-15-29-2)17-23(24)30-26(33)18-25(32)20-7-5-4-6-8-20/h4-14,17,25,29H,15-16,18H2,1-3H3,(H,30,33)