dimethyl 2-(phenylsulfonylmethyl)pyrimidine-4,5-dicarboxylate

Systemtic Name: dimethyl 2-(phenylsulfonylmethyl)pyrimidine-4,5-dicarboxylate Openeye Name: dimethyl 2-(benzenesulfonylmethyl)pyrimidine-4,5-dicarboxylate CAS Name: 2-(benzenesulfonylmethyl)pyrimidine-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(benzenesulfonylmethyl)pyrimidine-4,5-dicarboxylate Traditional Name: 2-(besylmethyl)pyrimidine-4,5-dicarboxylic acid dimethyl ester Formula: C15H14N2O6S MolecularWeight: 350.34646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(N=C1C(=O)OC)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CN=C(N=C1C(=O)OC)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H14N2O6S/c1-22-14(18)11-8-16-12(17-13(11)15(19)23-2)9-24(20,21)10-6-4-3-5-7-10/h3-8H,9H2,1-2H3