methyl 2-[[4-oxidanylidene-6-(trifluoromethyl)-1H-pyrimidin-2-yl]sulfanyl]ethanoate

Systemtic Name: methyl 2-[[4-oxidanylidene-6-(trifluoromethyl)-1H-pyrimidin-2-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[[4-oxo-6-(trifluoromethyl)-1H-pyrimidin-2-yl]sulfanyl]acetate CAS Name: 2-[[4-oxo-6-(trifluoromethyl)-1H-pyrimidin-2-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[[4-oxo-6-(trifluoromethyl)-1H-pyrimidin-2-yl]sulfanyl]acetate Traditional Name: 2-[[4-keto-6-(trifluoromethyl)-1H-pyrimidin-2-yl]thio]acetic acid methyl ester Formula: C8H7F3N2O3S MolecularWeight: 268.21299

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=O)C=C(N1)C(F)(F)F

Isomeric SMILES

COC(=O)CSC1=NC(=O)C=C(N1)C(F)(F)F

InChI

InChI=1S/C8H7F3N2O3S/c1-16-6(15)3-17-7-12-4(8(9,10)11)2-5(14)13-7/h2H,3H2,1H3,(H,12,13,14)