4-[bis(fluoranyl)methylsulfanyl]-6-methyl-2-propan-2-yl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[bis(fluoranyl)methylsulfanyl]-6-methyl-2-propan-2-yl-pyrimidine-5-carboxylic acid Openeye Name: 4-(difluoromethylsulfanyl)-2-isopropyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 4-(difluoromethylthio)-6-methyl-2-propan-2-yl-5-pyrimidinecarboxylic acid IUPAC Name: 4-(difluoromethylsulfanyl)-6-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid Traditional Name: 4-(difluoromethylthio)-2-isopropyl-6-methyl-pyrimidine-5-carboxylic acid Formula: C10H12F2N2O2S MolecularWeight: 262.276286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12F2N2O2S/c1-4(2)7-13-5(3)6(9(15)16)8(14-7)17-10(11)12/h4,10H,1-3H3,(H,15,16)