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

Systemtic Name: 1-cyclohexylcarbonyl-N-methyl-N-[2-(methylamino)ethyl]-2-(4-methylphenyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: 1-(cyclohexanecarbonyl)-N-methyl-N-[2-(methylamino)ethyl]-4-oxo-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: 1-[cyclohexyl(oxo)methyl]-N-methyl-N-[2-(methylamino)ethyl]-2-(4-methylphenyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: 1-(cyclohexanecarbonyl)-N-methyl-N-[2-(methylamino)ethyl]-2-(4-methylphenyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: 1-(cyclohexanecarbonyl)-4-keto-N-methyl-N-[2-(methylamino)ethyl]-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C28H36N4O3 MolecularWeight: 476.61044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)C4CCCCC4)C=CC(=C3)C(=O)N(C)CCNC

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)C4CCCCC4)C=CC(=C3)C(=O)N(C)CCNC

InChI

InChI=1S/C28H36N4O3/c1-19-9-11-20(12-10-19)25-18-26(33)30-23-17-22(27(34)31(3)16-15-29-2)13-14-24(23)32(25)28(35)21-7-5-4-6-8-21/h9-14,17,21,25,29H,4-8,15-16,18H2,1-3H3,(H,30,33)