N-(2-azanylethyl)-2-cyclohexyl-4-oxidanylidene-1-(phenylcarbonyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide

Systemtic Name: N-(2-azanylethyl)-2-cyclohexyl-4-oxidanylidene-1-(phenylcarbonyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-(2-aminoethyl)-1-benzoyl-2-cyclohexyl-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-(2-aminoethyl)-1-benzoyl-2-cyclohexyl-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-(2-aminoethyl)-1-benzoyl-2-cyclohexyl-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: N-(2-aminoethyl)-1-benzoyl-2-cyclohexyl-4-keto-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)C4=CC=CC=C4)C=CC(=C3)C(=O)NCCN

Isomeric SMILES

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)C4=CC=CC=C4)C=CC(=C3)C(=O)NCCN

InChI

InChI=1S/C25H30N4O3/c26-13-14-27-24(31)19-11-12-21-20(15-19)28-23(30)16-22(17-7-3-1-4-8-17)29(21)25(32)18-9-5-2-6-10-18/h2,5-6,9-12,15,17,22H,1,3-4,7-8,13-14,16,26H2,(H,27,31)(H,28,30)