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

Systemtic Name: 4-methyl-6-(2-methylpropylsulfanyl)-2-propan-2-yl-pyrimidine-5-carboxylic acid Openeye Name: 4-isobutylsulfanyl-2-isopropyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 4-methyl-6-(2-methylpropylthio)-2-propan-2-yl-5-pyrimidinecarboxylic acid IUPAC Name: 4-methyl-6-(2-methylpropylsulfanyl)-2-propan-2-ylpyrimidine-5-carboxylic acid Traditional Name: 4-(isobutylthio)-2-isopropyl-6-methyl-pyrimidine-5-carboxylic acid Formula: C13H20N2O2S MolecularWeight: 268.3751

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O2S/c1-7(2)6-18-12-10(13(16)17)9(5)14-11(15-12)8(3)4/h7-8H,6H2,1-5H3,(H,16,17)