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

Systemtic Name: 4-methyl-2-propan-2-yl-6-(pyrazin-2-ylmethylsulfanyl)pyrimidine-5-carboxylic acid Openeye Name: 2-isopropyl-4-methyl-6-(pyrazin-2-ylmethylsulfanyl)pyrimidine-5-carboxylic acid CAS Name: 4-methyl-2-propan-2-yl-6-(2-pyrazinylmethylthio)-5-pyrimidinecarboxylic acid IUPAC Name: 4-methyl-2-propan-2-yl-6-(pyrazin-2-ylmethylsulfanyl)pyrimidine-5-carboxylic acid Traditional Name: 2-isopropyl-4-methyl-6-(pyrazin-2-ylmethylthio)pyrimidine-5-carboxylic acid Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C(C)C)SCC2=NC=CN=C2)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C(C)C)SCC2=NC=CN=C2)C(=O)O

InChI

InChI=1S/C14H16N4O2S/c1-8(2)12-17-9(3)11(14(19)20)13(18-12)21-7-10-6-15-4-5-16-10/h4-6,8H,7H2,1-3H3,(H,19,20)