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

Systemtic Name: 2-methylsulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxylic acid Openeye Name: 2-methylsulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxylic acid CAS Name: 2-(methylthio)-6-phenyl-4-(trifluoromethyl)-3-pyridinecarboxylic acid IUPAC Name: 2-methylsulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxylic acid Traditional Name: 2-(methylthio)-6-phenyl-4-(trifluoromethyl)nicotinic acid Formula: C14H10F3NO2S MolecularWeight: 313.29491

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=CC(=N1)C2=CC=CC=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

CSC1=C(C(=CC(=N1)C2=CC=CC=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C14H10F3NO2S/c1-21-12-11(13(19)20)9(14(15,16)17)7-10(18-12)8-5-3-2-4-6-8/h2-7H,1H3,(H,19,20)