6-(4-methoxyphenyl)-2-methylsulfanyl-4-(trifluoromethyl)pyridine-3-carboxylic acid

Systemtic Name: 6-(4-methoxyphenyl)-2-methylsulfanyl-4-(trifluoromethyl)pyridine-3-carboxylic acid Openeye Name: 6-(4-methoxyphenyl)-2-methylsulfanyl-4-(trifluoromethyl)pyridine-3-carboxylic acid CAS Name: 6-(4-methoxyphenyl)-2-(methylthio)-4-(trifluoromethyl)-3-pyridinecarboxylic acid IUPAC Name: 6-(4-methoxyphenyl)-2-methylsulfanyl-4-(trifluoromethyl)pyridine-3-carboxylic acid Traditional Name: 6-(4-methoxyphenyl)-2-(methylthio)-4-(trifluoromethyl)nicotinic acid Formula: C15H12F3NO3S MolecularWeight: 343.32089

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C(=O)O)SC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C(=O)O)SC

InChI

InChI=1S/C15H12F3NO3S/c1-22-9-5-3-8(4-6-9)11-7-10(15(16,17)18)12(14(20)21)13(19-11)23-2/h3-7H,1-2H3,(H,20,21)