4-[bis(fluoranyl)methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[bis(fluoranyl)methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid Openeye Name: 4-(difluoromethylsulfanyl)-2,6-dimethyl-pyrimidine-5-carboxylic acid CAS Name: 4-(difluoromethylthio)-2,6-dimethyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-(difluoromethylsulfanyl)-2,6-dimethylpyrimidine-5-carboxylic acid Traditional Name: 4-(difluoromethylthio)-2,6-dimethyl-pyrimidine-5-carboxylic acid Formula: C8H8F2N2O2S MolecularWeight: 234.223126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8F2N2O2S/c1-3-5(7(13)14)6(15-8(9)10)12-4(2)11-3/h8H,1-2H3,(H,13,14)