5-(azepan-1-ylcarbonyl)-1-butan-2-yl-N-[2-(4-chlorophenyl)ethyl]-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 5-(azepan-1-ylcarbonyl)-1-butan-2-yl-N-[2-(4-chlorophenyl)ethyl]-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-N-[2-(4-chlorophenyl)ethyl]-4-oxo-1-sec-butyl-pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-1-butan-2-yl-N-[2-(4-chlorophenyl)ethyl]-4-oxo-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-1-butan-2-yl-N-[2-(4-chlorophenyl)ethyl]-4-oxopyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-N-[2-(4-chlorophenyl)ethyl]-4-keto-1-sec-butyl-nicotinamide Formula: C25H32ClN3O3 MolecularWeight: 457.99288

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H32ClN3O3/c1-3-18(2)29-16-21(24(31)27-13-12-19-8-10-20(26)11-9-19)23(30)22(17-29)25(32)28-14-6-4-5-7-15-28/h8-11,16-18H,3-7,12-15H2,1-2H3,(H,27,31)