5-(azepan-1-ylcarbonyl)-1-butan-2-yl-4-oxidanylidene-N-(3-phenylpropyl)pyridine-3-carboxamide

Systemtic Name: 5-(azepan-1-ylcarbonyl)-1-butan-2-yl-4-oxidanylidene-N-(3-phenylpropyl)pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-4-oxo-N-(3-phenylpropyl)-1-sec-butyl-pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-1-butan-2-yl-4-oxo-N-(3-phenylpropyl)-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-1-butan-2-yl-4-oxo-N-(3-phenylpropyl)pyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-4-keto-N-(3-phenylpropyl)-1-sec-butyl-nicotinamide Formula: C26H35N3O3 MolecularWeight: 437.5744

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCCCC3=CC=CC=C3

Isomeric SMILES

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCCCC3=CC=CC=C3

InChI

InChI=1S/C26H35N3O3/c1-3-20(2)29-18-22(25(31)27-15-11-14-21-12-7-6-8-13-21)24(30)23(19-29)26(32)28-16-9-4-5-10-17-28/h6-8,12-13,18-20H,3-5,9-11,14-17H2,1-2H3,(H,27,31)