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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NC(C)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NC(C)C3=CC=CC=C3Cl

InChI

InChI=1S/C25H32ClN3O3/c1-17(2)14-28-15-20(24(31)27-18(3)19-10-6-7-11-22(19)26)23(30)21(16-28)25(32)29-12-8-4-5-9-13-29/h6-7,10-11,15-18H,4-5,8-9,12-14H2,1-3H3,(H,27,31)