methyl 4-(3-chlorophenyl)-2-oxidanylidene-6-(phenylsulfonylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-(3-chlorophenyl)-2-oxidanylidene-6-(phenylsulfonylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl 6-(benzenesulfonylmethyl)-4-(3-chlorophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-(benzenesulfonylmethyl)-4-(3-chlorophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-(benzenesulfonylmethyl)-4-(3-chlorophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-(besylmethyl)-4-(3-chlorophenyl)-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C19H17ClN2O5S MolecularWeight: 420.86668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)Cl)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)Cl)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H17ClN2O5S/c1-27-18(23)16-15(11-28(25,26)14-8-3-2-4-9-14)21-19(24)22-17(16)12-6-5-7-13(20)10-12/h2-10,17H,11H2,1H3,(H2,21,22,24)