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

Systemtic Name: 5-(azepan-1-ylcarbonyl)-1-butan-2-yl-N-[(3-fluorophenyl)methyl]-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 5-(azepane-1-carbonyl)-N-[(3-fluorophenyl)methyl]-4-oxo-1-sec-butyl-pyridine-3-carboxamide CAS Name: 5-[1-azepanyl(oxo)methyl]-1-butan-2-yl-N-[(3-fluorophenyl)methyl]-4-oxo-3-pyridinecarboxamide IUPAC Name: 5-(azepane-1-carbonyl)-1-butan-2-yl-N-[(3-fluorophenyl)methyl]-4-oxopyridine-3-carboxamide Traditional Name: 5-(azepane-1-carbonyl)-N-(3-fluorobenzyl)-4-keto-1-sec-butyl-nicotinamide Formula: C24H30FN3O3 MolecularWeight: 427.511703

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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=C3)F

Isomeric SMILES

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

InChI

InChI=1S/C24H30FN3O3/c1-3-17(2)28-15-20(23(30)26-14-18-9-8-10-19(25)13-18)22(29)21(16-28)24(31)27-11-6-4-5-7-12-27/h8-10,13,15-17H,3-7,11-12,14H2,1-2H3,(H,26,30)