4-methyl-6-(2-oxidanylidene-2-propan-2-yloxy-ethyl)sulfanyl-2-propan-2-yl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-methyl-6-(2-oxidanylidene-2-propan-2-yloxy-ethyl)sulfanyl-2-propan-2-yl-pyrimidine-5-carboxylic acid Openeye Name: 4-(2-isopropoxy-2-oxo-ethyl)sulfanyl-2-isopropyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 4-methyl-6-[(2-oxo-2-propan-2-yloxyethyl)thio]-2-propan-2-yl-5-pyrimidinecarboxylic acid IUPAC Name: 4-methyl-6-(2-oxo-2-propan-2-yloxyethyl)sulfanyl-2-propan-2-ylpyrimidine-5-carboxylic acid Traditional Name: 4-[(2-isopropoxy-2-keto-ethyl)thio]-2-isopropyl-6-methyl-pyrimidine-5-carboxylic acid Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O4S/c1-7(2)12-15-9(5)11(14(18)19)13(16-12)21-6-10(17)20-8(3)4/h7-8H,6H2,1-5H3,(H,18,19)