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

Systemtic Name: 4-methyl-6-(oxan-2-ylmethylsulfanyl)-2-propan-2-yl-pyrimidine-5-carboxylic acid Openeye Name: 2-isopropyl-4-methyl-6-(tetrahydropyran-2-ylmethylsulfanyl)pyrimidine-5-carboxylic acid CAS Name: 4-methyl-6-(2-oxanylmethylthio)-2-propan-2-yl-5-pyrimidinecarboxylic acid IUPAC Name: 4-methyl-6-(oxan-2-ylmethylsulfanyl)-2-propan-2-ylpyrimidine-5-carboxylic acid Traditional Name: 2-isopropyl-4-methyl-6-(tetrahydropyran-2-ylmethylthio)pyrimidine-5-carboxylic acid Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3S/c1-9(2)13-16-10(3)12(15(18)19)14(17-13)21-8-11-6-4-5-7-20-11/h9,11H,4-8H2,1-3H3,(H,18,19)