2-ethyl-4-methyl-6-(2-methylpropylsulfanyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-ethyl-4-methyl-6-(2-methylpropylsulfanyl)pyrimidine-5-carboxylic acid Openeye Name: 2-ethyl-4-isobutylsulfanyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 2-ethyl-4-methyl-6-(2-methylpropylthio)-5-pyrimidinecarboxylic acid IUPAC Name: 2-ethyl-4-methyl-6-(2-methylpropylsulfanyl)pyrimidine-5-carboxylic acid Traditional Name: 2-ethyl-4-(isobutylthio)-6-methyl-pyrimidine-5-carboxylic acid Formula: C12H18N2O2S MolecularWeight: 254.34852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O2S/c1-5-9-13-8(4)10(12(15)16)11(14-9)17-6-7(2)3/h7H,5-6H2,1-4H3,(H,15,16)