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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCC3=C(C=CC(=C3)F)C

Isomeric SMILES

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N2CCCCCC2)C(=O)NCC3=C(C=CC(=C3)F)C

InChI

InChI=1S/C25H32FN3O3/c1-4-18(3)29-15-21(24(31)27-14-19-13-20(26)10-9-17(19)2)23(30)22(16-29)25(32)28-11-7-5-6-8-12-28/h9-10,13,15-16,18H,4-8,11-12,14H2,1-3H3,(H,27,31)