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

Systemtic Name: 5-(azepan-1-ylcarbonyl)-1-butan-2-yl-N-methyl-4-oxidanylidene-N-phenethyl-pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-N-methyl-4-oxo-N-phenethyl-1-sec-butyl-pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-1-butan-2-yl-N-methyl-4-oxo-N-phenethyl-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-1-butan-2-yl-N-methyl-4-oxo-N-phenethylpyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-4-keto-N-methyl-N-phenethyl-1-sec-butyl-nicotinamide Formula: C26H35N3O3 MolecularWeight: 437.5744

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N(C)CCC2=CC=CC=C2)C(=O)N3CCCCCC3

Isomeric SMILES

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N(C)CCC2=CC=CC=C2)C(=O)N3CCCCCC3

InChI

InChI=1S/C26H35N3O3/c1-4-20(2)29-18-22(25(31)27(3)17-14-21-12-8-7-9-13-21)24(30)23(19-29)26(32)28-15-10-5-6-11-16-28/h7-9,12-13,18-20H,4-6,10-11,14-17H2,1-3H3