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

Systemtic Name: 5-(azepan-1-ylcarbonyl)-N-methyl-1-(2-methylpropyl)-4-oxidanylidene-N-(phenylmethyl)pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-N-benzyl-1-isobutyl-N-methyl-4-oxo-pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-N-methyl-1-(2-methylpropyl)-4-oxo-N-(phenylmethyl)-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-N-benzyl-N-methyl-1-(2-methylpropyl)-4-oxopyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-N-benzyl-1-isobutyl-4-keto-N-methyl-nicotinamide Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N(C)CC2=CC=CC=C2)C(=O)N3CCCCCC3

Isomeric SMILES

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N(C)CC2=CC=CC=C2)C(=O)N3CCCCCC3

InChI

InChI=1S/C25H33N3O3/c1-19(2)15-27-17-21(24(30)26(3)16-20-11-7-6-8-12-20)23(29)22(18-27)25(31)28-13-9-4-5-10-14-28/h6-8,11-12,17-19H,4-5,9-10,13-16H2,1-3H3