5-(azepan-1-ylcarbonyl)-1-[(2S)-butan-2-yl]-N-[(6-methylpyridin-2-yl)methyl]-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 5-(azepan-1-ylcarbonyl)-1-[(2S)-butan-2-yl]-N-[(6-methylpyridin-2-yl)methyl]-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-1-[(1S)-1-methylpropyl]-N-[(6-methyl-2-pyridyl)methyl]-4-oxo-pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-1-[(2S)-butan-2-yl]-N-[(6-methyl-2-pyridinyl)methyl]-4-oxo-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-1-[(2S)-butan-2-yl]-N-[(6-methylpyridin-2-yl)methyl]-4-oxopyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-4-keto-1-[(1S)-1-methylpropyl]-N-[(6-methyl-2-pyridyl)methyl]nicotinamide Formula: C24H32N4O3 MolecularWeight: 424.53588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCC3=CC=CC(=N3)C

Isomeric SMILES

CC[C@H](C)N1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCC3=CC=CC(=N3)C

InChI

InChI=1S/C24H32N4O3/c1-4-18(3)28-15-20(23(30)25-14-19-11-9-10-17(2)26-19)22(29)21(16-28)24(31)27-12-7-5-6-8-13-27/h9-11,15-16,18H,4-8,12-14H2,1-3H3,(H,25,30)/t18-/m0/s1