2,4-dimethyl-6-(oxan-2-ylmethylsulfanyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2,4-dimethyl-6-(oxan-2-ylmethylsulfanyl)pyrimidine-5-carboxylic acid Openeye Name: 2,4-dimethyl-6-(tetrahydropyran-2-ylmethylsulfanyl)pyrimidine-5-carboxylic acid CAS Name: 2,4-dimethyl-6-(2-oxanylmethylthio)-5-pyrimidinecarboxylic acid IUPAC Name: 2,4-dimethyl-6-(oxan-2-ylmethylsulfanyl)pyrimidine-5-carboxylic acid Traditional Name: 2,4-dimethyl-6-(tetrahydropyran-2-ylmethylthio)pyrimidine-5-carboxylic acid Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SCC2CCCCO2)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C)SCC2CCCCO2)C(=O)O

InChI

InChI=1S/C13H18N2O3S/c1-8-11(13(16)17)12(15-9(2)14-8)19-7-10-5-3-4-6-18-10/h10H,3-7H2,1-2H3,(H,16,17)