4-fluoranyl-2-(2-pyridin-4-ylsulfanylethanoylamino)benzoic acid

Systemtic Name: 4-fluoranyl-2-(2-pyridin-4-ylsulfanylethanoylamino)benzoic acid Openeye Name: 4-fluoro-2-[[2-(4-pyridylsulfanyl)acetyl]amino]benzoic acid CAS Name: 4-fluoro-2-[[1-oxo-2-(pyridin-4-ylthio)ethyl]amino]benzoic acid IUPAC Name: 4-fluoro-2-[(2-pyridin-4-ylsulfanylacetyl)amino]benzoic acid Traditional Name: 4-fluoro-2-[[2-(4-pyridylthio)acetyl]amino]benzoic acid Formula: C14H11FN2O3S MolecularWeight: 306.312143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)NC(=O)CSC2=CC=NC=C2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1F)NC(=O)CSC2=CC=NC=C2)C(=O)O

InChI

InChI=1S/C14H11FN2O3S/c15-9-1-2-11(14(19)20)12(7-9)17-13(18)8-21-10-3-5-16-6-4-10/h1-7H,8H2,(H,17,18)(H,19,20)