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

Systemtic Name: 5-(azepan-1-ylcarbonyl)-1-(2-methylpropyl)-4-oxidanylidene-N-[(4-phenyloxan-4-yl)methyl]pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-1-isobutyl-4-oxo-N-[(4-phenyltetrahydropyran-4-yl)methyl]pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-1-(2-methylpropyl)-4-oxo-N-[(4-phenyl-4-oxanyl)methyl]-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-1-(2-methylpropyl)-4-oxo-N-[(4-phenyloxan-4-yl)methyl]pyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-1-isobutyl-4-keto-N-[(4-phenyltetrahydropyran-4-yl)methyl]nicotinamide Formula: C29H39N3O4 MolecularWeight: 493.63766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCC3(CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCC3(CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C29H39N3O4/c1-22(2)18-31-19-24(26(33)25(20-31)28(35)32-14-8-3-4-9-15-32)27(34)30-21-29(12-16-36-17-13-29)23-10-6-5-7-11-23/h5-7,10-11,19-20,22H,3-4,8-9,12-18,21H2,1-2H3,(H,30,34)