2-cyclopropyl-4-methyl-6-(3-oxidanylpropylsulfanyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-cyclopropyl-4-methyl-6-(3-oxidanylpropylsulfanyl)pyrimidine-5-carboxylic acid Openeye Name: 2-cyclopropyl-4-(3-hydroxypropylsulfanyl)-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 2-cyclopropyl-4-(3-hydroxypropylthio)-6-methyl-5-pyrimidinecarboxylic acid IUPAC Name: 2-cyclopropyl-4-(3-hydroxypropylsulfanyl)-6-methylpyrimidine-5-carboxylic acid Traditional Name: 2-cyclopropyl-4-(3-hydroxypropylthio)-6-methyl-pyrimidine-5-carboxylic acid Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCCCO)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCCCO)C(=O)O

InChI

InChI=1S/C12H16N2O3S/c1-7-9(12(16)17)11(18-6-2-5-15)14-10(13-7)8-3-4-8/h8,15H,2-6H2,1H3,(H,16,17)