2-ethyl-4-methyl-6-[2,2,2-tris(fluoranyl)ethylsulfanyl]pyrimidine-5-carboxylic acid

Systemtic Name: 2-ethyl-4-methyl-6-[2,2,2-tris(fluoranyl)ethylsulfanyl]pyrimidine-5-carboxylic acid Openeye Name: 2-ethyl-4-methyl-6-(2,2,2-trifluoroethylsulfanyl)pyrimidine-5-carboxylic acid CAS Name: 2-ethyl-4-methyl-6-(2,2,2-trifluoroethylthio)-5-pyrimidinecarboxylic acid IUPAC Name: 2-ethyl-4-methyl-6-(2,2,2-trifluoroethylsulfanyl)pyrimidine-5-carboxylic acid Traditional Name: 2-ethyl-4-methyl-6-(2,2,2-trifluoroethylthio)pyrimidine-5-carboxylic acid Formula: C10H11F3N2O2S MolecularWeight: 280.26675

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCC(F)(F)F)C(=O)O)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCC(F)(F)F)C(=O)O)C

InChI

InChI=1S/C10H11F3N2O2S/c1-3-6-14-5(2)7(9(16)17)8(15-6)18-4-10(11,12)13/h3-4H2,1-2H3,(H,16,17)