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

Systemtic Name: 2-cyclopropyl-4-methyl-6-(2-oxidanylidene-2-propan-2-yloxy-ethyl)sulfanyl-pyrimidine-5-carboxylic acid Openeye Name: 2-cyclopropyl-4-(2-isopropoxy-2-oxo-ethyl)sulfanyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 2-cyclopropyl-4-methyl-6-[(2-oxo-2-propan-2-yloxyethyl)thio]-5-pyrimidinecarboxylic acid IUPAC Name: 2-cyclopropyl-4-methyl-6-(2-oxo-2-propan-2-yloxyethyl)sulfanylpyrimidine-5-carboxylic acid Traditional Name: 2-cyclopropyl-4-[(2-isopropoxy-2-keto-ethyl)thio]-6-methyl-pyrimidine-5-carboxylic acid Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)OC(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)OC(C)C)C(=O)O

InChI

InChI=1S/C14H18N2O4S/c1-7(2)20-10(17)6-21-13-11(14(18)19)8(3)15-12(16-13)9-4-5-9/h7,9H,4-6H2,1-3H3,(H,18,19)