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

Systemtic Name: 2-[[5-[(4-fluorophenyl)methyl]-6-oxidanyl-4-oxidanylidene-1H-pyridin-2-yl]sulfanyl]hexanoic acid Openeye Name: 2-[[5-[(4-fluorophenyl)methyl]-6-hydroxy-4-oxo-1H-pyridin-2-yl]sulfanyl]hexanoic acid CAS Name: 2-[[5-[(4-fluorophenyl)methyl]-6-hydroxy-4-oxo-1H-pyridin-2-yl]thio]hexanoic acid IUPAC Name: 2-[[5-[(4-fluorophenyl)methyl]-6-hydroxy-4-oxo-1H-pyridin-2-yl]sulfanyl]hexanoic acid Traditional Name: 2-[[5-(4-fluorobenzyl)-6-hydroxy-4-keto-1H-pyridin-2-yl]thio]hexanoic acid Formula: C18H20FNO4S MolecularWeight: 365.419103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20FNO4S/c1-2-3-4-15(18(23)24)25-16-10-14(21)13(17(22)20-16)9-11-5-7-12(19)8-6-11/h5-8,10,15H,2-4,9H2,1H3,(H,23,24)(H2,20,21,22)