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

Systemtic Name: 5-(azepan-1-ylcarbonyl)-N-[(1R)-1-(3-methoxyphenyl)ethyl]-1-(2-methylpropyl)-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-1-isobutyl-N-[(1R)-1-(3-methoxyphenyl)ethyl]-4-oxo-pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-N-[(1R)-1-(3-methoxyphenyl)ethyl]-1-(2-methylpropyl)-4-oxo-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-N-[(1R)-1-(3-methoxyphenyl)ethyl]-1-(2-methylpropyl)-4-oxopyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-1-isobutyl-4-keto-N-[(1R)-1-(3-methoxyphenyl)ethyl]nicotinamide Formula: C26H35N3O4 MolecularWeight: 453.5738

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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=C3)OC

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)OC)NC(=O)C2=CN(C=C(C2=O)C(=O)N3CCCCCC3)CC(C)C

InChI

InChI=1S/C26H35N3O4/c1-18(2)15-28-16-22(25(31)27-19(3)20-10-9-11-21(14-20)33-4)24(30)23(17-28)26(32)29-12-7-5-6-8-13-29/h9-11,14,16-19H,5-8,12-13,15H2,1-4H3,(H,27,31)/t19-/m1/s1