6-methyl-2-oxidanylidene-4-[2,2,2-tris(fluoranyl)ethylsulfanyl]-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 6-methyl-2-oxidanylidene-4-[2,2,2-tris(fluoranyl)ethylsulfanyl]-1H-pyrimidine-5-carboxylic acid Openeye Name: 6-methyl-2-oxo-4-(2,2,2-trifluoroethylsulfanyl)-1H-pyrimidine-5-carboxylic acid CAS Name: 6-methyl-2-oxo-4-(2,2,2-trifluoroethylthio)-1H-pyrimidine-5-carboxylic acid IUPAC Name: 6-methyl-2-oxo-4-(2,2,2-trifluoroethylsulfanyl)-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-keto-6-methyl-4-(2,2,2-trifluoroethylthio)-1H-pyrimidine-5-carboxylic acid Formula: C8H7F3N2O3S MolecularWeight: 268.21299

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC(F)(F)F)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC(F)(F)F)C(=O)O

InChI

InChI=1S/C8H7F3N2O3S/c1-3-4(6(14)15)5(13-7(16)12-3)17-2-8(9,10)11/h2H2,1H3,(H,14,15)(H,12,13,16)