2-[4-(4-methylsulfanylphenyl)-3-(trifluoromethyl)phenyl]-5-oxidanyl-pyridine-4-carboxylic acid

Systemtic Name: 2-[4-(4-methylsulfanylphenyl)-3-(trifluoromethyl)phenyl]-5-oxidanyl-pyridine-4-carboxylic acid Openeye Name: 5-hydroxy-2-[4-(4-methylsulfanylphenyl)-3-(trifluoromethyl)phenyl]pyridine-4-carboxylic acid CAS Name: 5-hydroxy-2-[4-[4-(methylthio)phenyl]-3-(trifluoromethyl)phenyl]-4-pyridinecarboxylic acid IUPAC Name: 5-hydroxy-2-[4-(4-methylsulfanylphenyl)-3-(trifluoromethyl)phenyl]pyridine-4-carboxylic acid Traditional Name: 5-hydroxy-2-[4-[4-(methylthio)phenyl]-3-(trifluoromethyl)phenyl]isonicotinic acid Formula: C20H14F3NO3S MolecularWeight: 405.39027

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(C=C(C=C2)C3=NC=C(C(=C3)C(=O)O)O)C(F)(F)F

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(C=C(C=C2)C3=NC=C(C(=C3)C(=O)O)O)C(F)(F)F

InChI

InChI=1S/C20H14F3NO3S/c1-28-13-5-2-11(3-6-13)14-7-4-12(8-16(14)20(21,22)23)17-9-15(19(26)27)18(25)10-24-17/h2-10,25H,1H3,(H,26,27)