(4-ethanoyl-2-fluoranyl-phenyl) 5-chloranyl-2-methylsulfonyl-pyrimidine-4-carboxylate

Systemtic Name: (4-ethanoyl-2-fluoranyl-phenyl) 5-chloranyl-2-methylsulfonyl-pyrimidine-4-carboxylate Openeye Name: (4-acetyl-2-fluoro-phenyl) 5-chloro-2-methylsulfonyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-methylsulfonyl-4-pyrimidinecarboxylic acid (4-acetyl-2-fluorophenyl) ester IUPAC Name: (4-acetyl-2-fluorophenyl) 5-chloro-2-methylsulfonylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-mesyl-pyrimidine-4-carboxylic acid (4-acetyl-2-fluoro-phenyl) ester Formula: C14H10ClFN2O5S MolecularWeight: 372.756003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)C)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)C)F

InChI

InChI=1S/C14H10ClFN2O5S/c1-7(19)8-3-4-11(10(16)5-8)23-13(20)12-9(15)6-17-14(18-12)24(2,21)22/h3-6H,1-2H3