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

Systemtic Name: N-(3-azanyl-2,2-dimethyl-propyl)-2-cyclohexyl-4-oxidanylidene-1-(3-phenylpropanoyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-(3-amino-2,2-dimethyl-propyl)-2-cyclohexyl-4-oxo-1-(3-phenylpropanoyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-(3-amino-2,2-dimethylpropyl)-2-cyclohexyl-4-oxo-1-(1-oxo-3-phenylpropyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-(3-amino-2,2-dimethylpropyl)-2-cyclohexyl-4-oxo-1-(3-phenylpropanoyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: N-(3-amino-2,2-dimethyl-propyl)-2-cyclohexyl-1-hydrocinnamoyl-4-keto-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C30H40N4O3 MolecularWeight: 504.6636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)CNC(=O)C1=CC2=C(C=C1)N(C(CC(=O)N2)C3CCCCC3)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)(CN)CNC(=O)C1=CC2=C(C=C1)N(C(CC(=O)N2)C3CCCCC3)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C30H40N4O3/c1-30(2,19-31)20-32-29(37)23-14-15-25-24(17-23)33-27(35)18-26(22-11-7-4-8-12-22)34(25)28(36)16-13-21-9-5-3-6-10-21/h3,5-6,9-10,14-15,17,22,26H,4,7-8,11-13,16,18-20,31H2,1-2H3,(H,32,37)(H,33,35)