methyl 5-chloranyl-2-methylsulfonyl-pyrimidine-4-carboxylate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=NC=C1Cl)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=NC(=NC=C1Cl)S(=O)(=O)C

InChI

InChI=1S/C7H7ClN2O4S/c1-14-6(11)5-4(8)3-9-7(10-5)15(2,12)13/h3H,1-2H3