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

Systemtic Name: N-(2-azanylcyclohexyl)-2-cyclohexyl-4-oxidanylidene-1-(3-phenylpropanoyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-(2-aminocyclohexyl)-2-cyclohexyl-4-oxo-1-(3-phenylpropanoyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-(2-aminocyclohexyl)-2-cyclohexyl-4-oxo-1-(1-oxo-3-phenylpropyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-(2-aminocyclohexyl)-2-cyclohexyl-4-oxo-1-(3-phenylpropanoyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: N-(2-aminocyclohexyl)-2-cyclohexyl-1-hydrocinnamoyl-4-keto-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C31H40N4O3 MolecularWeight: 516.6743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)CCC4=CC=CC=C4)C=CC(=C3)C(=O)NC5CCCCC5N

Isomeric SMILES

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)CCC4=CC=CC=C4)C=CC(=C3)C(=O)NC5CCCCC5N

InChI

InChI=1S/C31H40N4O3/c32-24-13-7-8-14-25(24)34-31(38)23-16-17-27-26(19-23)33-29(36)20-28(22-11-5-2-6-12-22)35(27)30(37)18-15-21-9-3-1-4-10-21/h1,3-4,9-10,16-17,19,22,24-25,28H,2,5-8,11-15,18,20,32H2,(H,33,36)(H,34,38)