2-butyl-3-(cyclobutylmethyl)-N'-[1-[(3-naphthalen-2-ylphenyl)methyl]-2-oxidanylidene-azepan-3-yl]butanediamide

Systemtic Name: 2-butyl-3-(cyclobutylmethyl)-N'-[1-[(3-naphthalen-2-ylphenyl)methyl]-2-oxidanylidene-azepan-3-yl]butanediamide Openeye Name: 2-butyl-3-(cyclobutylmethyl)-N'-[1-[[3-(2-naphthyl)phenyl]methyl]-2-oxo-azepan-3-yl]butanediamide CAS Name: 2-butyl-3-(cyclobutylmethyl)-N'-[1-[[3-(2-naphthalenyl)phenyl]methyl]-2-oxo-3-azepanyl]butanediamide IUPAC Name: 2-butyl-3-(cyclobutylmethyl)-N'-[1-[(3-naphthalen-2-ylphenyl)methyl]-2-oxoazepan-3-yl]butanediamide Traditional Name: 2-butyl-3-(cyclobutylmethyl)-N'-[2-keto-1-[3-(2-naphthyl)benzyl]azepan-3-yl]succinamide Formula: C36H45N3O3 MolecularWeight: 567.7608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CC1CCC1)C(=O)NC2CCCCN(C2=O)CC3=CC=CC(=C3)C4=CC5=CC=CC=C5C=C4)C(=O)N

Isomeric SMILES

CCCCC(C(CC1CCC1)C(=O)NC2CCCCN(C2=O)CC3=CC=CC(=C3)C4=CC5=CC=CC=C5C=C4)C(=O)N

InChI

InChI=1S/C36H45N3O3/c1-2-3-16-31(34(37)40)32(22-25-10-8-11-25)35(41)38-33-17-6-7-20-39(36(33)42)24-26-12-9-15-28(21-26)30-19-18-27-13-4-5-14-29(27)23-30/h4-5,9,12-15,18-19,21,23,25,31-33H,2-3,6-8,10-11,16-17,20,22,24H2,1H3,(H2,37,40)(H,38,41)