propan-2-yl 5-chloranyl-2-methylsulfonyl-pyrimidine-4-carboxylate

Systemtic Name: propan-2-yl 5-chloranyl-2-methylsulfonyl-pyrimidine-4-carboxylate Openeye Name: isopropyl 5-chloro-2-methylsulfonyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-methylsulfonyl-4-pyrimidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-chloro-2-methylsulfonylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-mesyl-pyrimidine-4-carboxylic acid isopropyl ester Formula: C9H11ClN2O4S MolecularWeight: 278.71264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=NC(=NC=C1Cl)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)C1=NC(=NC=C1Cl)S(=O)(=O)C

InChI

InChI=1S/C9H11ClN2O4S/c1-5(2)16-8(13)7-6(10)4-11-9(12-7)17(3,14)15/h4-5H,1-3H3