2-ethyl-4-methyl-6-[(1-methylimidazol-2-yl)methylsulfanyl]pyrimidine-5-carboxylic acid

Systemtic Name: 2-ethyl-4-methyl-6-[(1-methylimidazol-2-yl)methylsulfanyl]pyrimidine-5-carboxylic acid Openeye Name: 2-ethyl-4-methyl-6-[(1-methylimidazol-2-yl)methylsulfanyl]pyrimidine-5-carboxylic acid CAS Name: 2-ethyl-4-methyl-6-[(1-methyl-2-imidazolyl)methylthio]-5-pyrimidinecarboxylic acid IUPAC Name: 2-ethyl-4-methyl-6-[(1-methylimidazol-2-yl)methylsulfanyl]pyrimidine-5-carboxylic acid Traditional Name: 2-ethyl-4-methyl-6-[(1-methylimidazol-2-yl)methylthio]pyrimidine-5-carboxylic acid Formula: C13H16N4O2S MolecularWeight: 292.35674

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCC2=NC=CN2C)C(=O)O)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCC2=NC=CN2C)C(=O)O)C

InChI

InChI=1S/C13H16N4O2S/c1-4-9-15-8(2)11(13(18)19)12(16-9)20-7-10-14-5-6-17(10)3/h5-6H,4,7H2,1-3H3,(H,18,19)