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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCC3(CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCC3(CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C30H41N3O3/c1-3-23(2)33-20-25(27(34)26(21-33)29(36)32-18-12-4-5-13-19-32)28(35)31-22-30(16-10-7-11-17-30)24-14-8-6-9-15-24/h6,8-9,14-15,20-21,23H,3-5,7,10-13,16-19,22H2,1-2H3,(H,31,35)