(4-methoxyphenyl) 5-bromanyl-2-ethylsulfonyl-pyrimidine-4-carboxylate

Systemtic Name: (4-methoxyphenyl) 5-bromanyl-2-ethylsulfonyl-pyrimidine-4-carboxylate Openeye Name: (4-methoxyphenyl) 5-bromo-2-ethylsulfonyl-pyrimidine-4-carboxylate CAS Name: 5-bromo-2-ethylsulfonyl-4-pyrimidinecarboxylic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 5-bromo-2-ethylsulfonylpyrimidine-4-carboxylate Traditional Name: 5-bromo-2-esyl-pyrimidine-4-carboxylic acid (4-methoxyphenyl) ester Formula: C14H13BrN2O5S MolecularWeight: 401.23242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)OC2=CC=C(C=C2)OC)Br

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)OC2=CC=C(C=C2)OC)Br

InChI

InChI=1S/C14H13BrN2O5S/c1-3-23(19,20)14-16-8-11(15)12(17-14)13(18)22-10-6-4-9(21-2)5-7-10/h4-8H,3H2,1-2H3