6-[bis(fluoranyl)methyl]-5-ethylsulfanyl-4-methyl-2-(trifluoromethyl)pyridine-3-carboxylic acid

Systemtic Name: 6-[bis(fluoranyl)methyl]-5-ethylsulfanyl-4-methyl-2-(trifluoromethyl)pyridine-3-carboxylic acid Openeye Name: 6-(difluoromethyl)-5-ethylsulfanyl-4-methyl-2-(trifluoromethyl)pyridine-3-carboxylic acid CAS Name: 6-(difluoromethyl)-5-(ethylthio)-4-methyl-2-(trifluoromethyl)-3-pyridinecarboxylic acid IUPAC Name: 6-(difluoromethyl)-5-ethylsulfanyl-4-methyl-2-(trifluoromethyl)pyridine-3-carboxylic acid Traditional Name: 6-(difluoromethyl)-5-(ethylthio)-4-methyl-2-(trifluoromethyl)nicotinic acid Formula: C11H10F5NO2S MolecularWeight: 315.259616

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(N=C(C(=C1C)C(=O)O)C(F)(F)F)C(F)F

Isomeric SMILES

CCSC1=C(N=C(C(=C1C)C(=O)O)C(F)(F)F)C(F)F

InChI

InChI=1S/C11H10F5NO2S/c1-3-20-7-4(2)5(10(18)19)8(11(14,15)16)17-6(7)9(12)13/h9H,3H2,1-2H3,(H,18,19)