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

Systemtic Name: N-(2-azanylethyl)-2-cyclohexyl-1-naphthalen-2-ylcarbonyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-(2-aminoethyl)-2-cyclohexyl-1-(naphthalene-2-carbonyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-(2-aminoethyl)-2-cyclohexyl-1-[2-naphthalenyl(oxo)methyl]-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-(2-aminoethyl)-2-cyclohexyl-1-(naphthalene-2-carbonyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: N-(2-aminoethyl)-2-cyclohexyl-4-keto-1-(2-naphthoyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C29H32N4O3 MolecularWeight: 484.58938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)C4=CC5=CC=CC=C5C=C4)C=CC(=C3)C(=O)NCCN

Isomeric SMILES

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)C4=CC5=CC=CC=C5C=C4)C=CC(=C3)C(=O)NCCN

InChI

InChI=1S/C29H32N4O3/c30-14-15-31-28(35)22-12-13-25-24(17-22)32-27(34)18-26(20-7-2-1-3-8-20)33(25)29(36)23-11-10-19-6-4-5-9-21(19)16-23/h4-6,9-13,16-17,20,26H,1-3,7-8,14-15,18,30H2,(H,31,35)(H,32,34)