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

Systemtic Name: 5-(azepan-1-ylcarbonyl)-1-(2-methylpropyl)-4-oxidanylidene-N-[(1-phenylcyclohexyl)methyl]pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-1-isobutyl-4-oxo-N-[(1-phenylcyclohexyl)methyl]pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-1-(2-methylpropyl)-4-oxo-N-[(1-phenylcyclohexyl)methyl]-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-1-(2-methylpropyl)-4-oxo-N-[(1-phenylcyclohexyl)methyl]pyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-1-isobutyl-4-keto-N-[(1-phenylcyclohexyl)methyl]nicotinamide Formula: C30H41N3O3 MolecularWeight: 491.66484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCC3(CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCC3(CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C30H41N3O3/c1-23(2)19-32-20-25(27(34)26(21-32)29(36)33-17-11-3-4-12-18-33)28(35)31-22-30(15-9-6-10-16-30)24-13-7-5-8-14-24/h5,7-8,13-14,20-21,23H,3-4,6,9-12,15-19,22H2,1-2H3,(H,31,35)