6-chloranyl-5-methyl-2-methylsulfanyl-pyrimidine-4-carboxylic acid

Systemtic Name: 6-chloranyl-5-methyl-2-methylsulfanyl-pyrimidine-4-carboxylic acid Openeye Name: 6-chloro-5-methyl-2-methylsulfanyl-pyrimidine-4-carboxylic acid CAS Name: 6-chloro-5-methyl-2-(methylthio)-4-pyrimidinecarboxylic acid IUPAC Name: 6-chloro-5-methyl-2-methylsulfanylpyrimidine-4-carboxylic acid Traditional Name: 6-chloro-5-methyl-2-(methylthio)pyrimidine-4-carboxylic acid Formula: C7H7ClN2O2S MolecularWeight: 218.66068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1Cl)SC)C(=O)O

Isomeric SMILES

CC1=C(N=C(N=C1Cl)SC)C(=O)O

InChI

InChI=1S/C7H7ClN2O2S/c1-3-4(6(11)12)9-7(13-2)10-5(3)8/h1-2H3,(H,11,12)