2-[[5-[(4-fluorophenyl)methyl]-6-oxidanyl-4-oxidanylidene-1H-pyridin-2-yl]sulfanyl]propanoic acid

Systemtic Name: 2-[[5-[(4-fluorophenyl)methyl]-6-oxidanyl-4-oxidanylidene-1H-pyridin-2-yl]sulfanyl]propanoic acid Openeye Name: 2-[[5-[(4-fluorophenyl)methyl]-6-hydroxy-4-oxo-1H-pyridin-2-yl]sulfanyl]propanoic acid CAS Name: 2-[[5-[(4-fluorophenyl)methyl]-6-hydroxy-4-oxo-1H-pyridin-2-yl]thio]propanoic acid IUPAC Name: 2-[[5-[(4-fluorophenyl)methyl]-6-hydroxy-4-oxo-1H-pyridin-2-yl]sulfanyl]propanoic acid Traditional Name: 2-[[5-(4-fluorobenzyl)-6-hydroxy-4-keto-1H-pyridin-2-yl]thio]propionic acid Formula: C15H14FNO4S MolecularWeight: 323.339363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=CC(=O)C(=C(N1)O)CC2=CC=C(C=C2)F

Isomeric SMILES

CC(C(=O)O)SC1=CC(=O)C(=C(N1)O)CC2=CC=C(C=C2)F

InChI

InChI=1S/C15H14FNO4S/c1-8(15(20)21)22-13-7-12(18)11(14(19)17-13)6-9-2-4-10(16)5-3-9/h2-5,7-8H,6H2,1H3,(H,20,21)(H2,17,18,19)