ethyl 1-[[6-[bis(fluoranyl)methyl]-3-cyano-4-methyl-pyridin-2-yl]sulfanylmethyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[[6-[bis(fluoranyl)methyl]-3-cyano-4-methyl-pyridin-2-yl]sulfanylmethyl]pyrazole-3-carboxylate Openeye Name: ethyl 1-[[3-cyano-6-(difluoromethyl)-4-methyl-2-pyridyl]sulfanylmethyl]pyrazole-3-carboxylate CAS Name: 1-[[[3-cyano-6-(difluoromethyl)-4-methyl-2-pyridinyl]thio]methyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[3-cyano-6-(difluoromethyl)-4-methylpyridin-2-yl]sulfanylmethyl]pyrazole-3-carboxylate Traditional Name: 1-[[[3-cyano-6-(difluoromethyl)-4-methyl-2-pyridyl]thio]methyl]pyrazole-3-carboxylic acid ethyl ester Formula: C15H14F2N4O2S MolecularWeight: 352.359066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1)CSC2=C(C(=CC(=N2)C(F)F)C)C#N

Isomeric SMILES

CCOC(=O)C1=NN(C=C1)CSC2=C(C(=CC(=N2)C(F)F)C)C#N

InChI

InChI=1S/C15H14F2N4O2S/c1-3-23-15(22)11-4-5-21(20-11)8-24-14-10(7-18)9(2)6-12(19-14)13(16)17/h4-6,13H,3,8H2,1-2H3