methyl 2-[2-pyridin-2-yl-6-(trifluoromethyl)pyrimidin-4-yl]sulfanylethanoate

Systemtic Name: methyl 2-[2-pyridin-2-yl-6-(trifluoromethyl)pyrimidin-4-yl]sulfanylethanoate Openeye Name: methyl 2-[2-(2-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]sulfanylacetate CAS Name: 2-[[2-(2-pyridinyl)-6-(trifluoromethyl)-4-pyrimidinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[2-pyridin-2-yl-6-(trifluoromethyl)pyrimidin-4-yl]sulfanylacetate Traditional Name: 2-[[2-(2-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]thio]acetic acid methyl ester Formula: C13H10F3N3O2S MolecularWeight: 329.29761

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=NC(=C1)C(F)(F)F)C2=CC=CC=N2

Isomeric SMILES

COC(=O)CSC1=NC(=NC(=C1)C(F)(F)F)C2=CC=CC=N2

InChI

InChI=1S/C13H10F3N3O2S/c1-21-11(20)7-22-10-6-9(13(14,15)16)18-12(19-10)8-4-2-3-5-17-8/h2-6H,7H2,1H3