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

Systemtic Name: 4-chloranyl-6-methyl-2-methylsulfonyl-pyrimidine-5-carboxylic acid Openeye Name: 4-chloro-6-methyl-2-methylsulfonyl-pyrimidine-5-carboxylic acid CAS Name: 4-chloro-6-methyl-2-methylsulfonyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-chloro-6-methyl-2-methylsulfonylpyrimidine-5-carboxylic acid Traditional Name: 4-chloro-2-mesyl-6-methyl-pyrimidine-5-carboxylic acid Formula: C7H7ClN2O4S MolecularWeight: 250.65948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)S(=O)(=O)C)Cl)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)S(=O)(=O)C)Cl)C(=O)O

InChI

InChI=1S/C7H7ClN2O4S/c1-3-4(6(11)12)5(8)10-7(9-3)15(2,13)14/h1-2H3,(H,11,12)