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

Systemtic Name: 5-(azepan-1-ylcarbonyl)-N-[(5-fluoranyl-2-methyl-phenyl)methyl]-1-(2-methylpropyl)-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-N-[(5-fluoro-2-methyl-phenyl)methyl]-1-isobutyl-4-oxo-pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-N-[(5-fluoro-2-methylphenyl)methyl]-1-(2-methylpropyl)-4-oxo-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-N-[(5-fluoro-2-methylphenyl)methyl]-1-(2-methylpropyl)-4-oxopyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-N-(5-fluoro-2-methyl-benzyl)-1-isobutyl-4-keto-nicotinamide Formula: C25H32FN3O3 MolecularWeight: 441.538283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)CNC(=O)C2=CN(C=C(C2=O)C(=O)N3CCCCCC3)CC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)F)CNC(=O)C2=CN(C=C(C2=O)C(=O)N3CCCCCC3)CC(C)C

InChI

InChI=1S/C25H32FN3O3/c1-17(2)14-28-15-21(24(31)27-13-19-12-20(26)9-8-18(19)3)23(30)22(16-28)25(32)29-10-6-4-5-7-11-29/h8-9,12,15-17H,4-7,10-11,13-14H2,1-3H3,(H,27,31)