ethyl (4S)-2-oxidanylidene-6-(phenylsulfonylmethyl)-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-2-oxidanylidene-6-(phenylsulfonylmethyl)-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-(benzenesulfonylmethyl)-2-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-(benzenesulfonylmethyl)-2-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-(benzenesulfonylmethyl)-2-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-(besylmethyl)-2-keto-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H26N2O8S MolecularWeight: 490.52614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C(=C2)OC)OC)OC)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC(=C(C(=C2)OC)OC)OC)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H26N2O8S/c1-5-33-22(26)19-16(13-34(28,29)15-9-7-6-8-10-15)24-23(27)25-20(19)14-11-17(30-2)21(32-4)18(12-14)31-3/h6-12,20H,5,13H2,1-4H3,(H2,24,25,27)/t20-/m0/s1