methyl 5-[[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridinyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]thio]methyl]furan-2-carboxylic acid methyl ester Formula: C15H11F3N2O3S MolecularWeight: 356.31965

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC2=CC=C(O2)C(=O)OC)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC2=CC=C(O2)C(=O)OC)C(F)(F)F

InChI

InChI=1S/C15H11F3N2O3S/c1-8-5-12(15(16,17)18)20-13(10(8)6-19)24-7-9-3-4-11(23-9)14(21)22-2/h3-5H,7H2,1-2H3