1-[4-(butanoylamino)phenyl]-N-[(2-fluorophenyl)methyl]-2-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 1-[4-(butanoylamino)phenyl]-N-[(2-fluorophenyl)methyl]-2-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-[4-(butanoylamino)phenyl]-N-[(2-fluorophenyl)methyl]-2-oxo-pyridine-3-carboxamide CAS Name: N-[(2-fluorophenyl)methyl]-2-oxo-1-[4-(1-oxobutylamino)phenyl]-3-pyridinecarboxamide IUPAC Name: 1-[4-(butanoylamino)phenyl]-N-[(2-fluorophenyl)methyl]-2-oxopyridine-3-carboxamide Traditional Name: 1-(4-butyramidophenyl)-N-(2-fluorobenzyl)-2-keto-nicotinamide Formula: C23H22FN3O3 MolecularWeight: 407.437483

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)N2C=CC=C(C2=O)C(=O)NCC3=CC=CC=C3F

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)N2C=CC=C(C2=O)C(=O)NCC3=CC=CC=C3F

InChI

InChI=1S/C23H22FN3O3/c1-2-6-21(28)26-17-10-12-18(13-11-17)27-14-5-8-19(23(27)30)22(29)25-15-16-7-3-4-9-20(16)24/h3-5,7-14H,2,6,15H2,1H3,(H,25,29)(H,26,28)