ethyl (4R,5S,6Z)-4-(4-ethoxyphenyl)-2-oxidanylidene-6-(phenylsulfonylmethylidene)-1,3-diazinane-5-carboxylate

Systemtic Name: ethyl (4R,5S,6Z)-4-(4-ethoxyphenyl)-2-oxidanylidene-6-(phenylsulfonylmethylidene)-1,3-diazinane-5-carboxylate Openeye Name: ethyl (4Z,5S,6R)-4-(benzenesulfonylmethylene)-6-(4-ethoxyphenyl)-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4Z,5S,6R)-4-(benzenesulfonylmethylidene)-6-(4-ethoxyphenyl)-2-oxo-1,3-diazinane-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4Z,5S,6R)-4-(benzenesulfonylmethylidene)-6-(4-ethoxyphenyl)-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4Z,5S,6R)-4-(besylmethylene)-2-keto-6-p-phenetyl-hexahydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H24N2O6S MolecularWeight: 444.50076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(C(=CS(=O)(=O)C3=CC=CC=C3)NC(=O)N2)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H]2[C@@H](/C(=C/S(=O)(=O)C3=CC=CC=C3)/NC(=O)N2)C(=O)OCC

InChI

InChI=1S/C22H24N2O6S/c1-3-29-16-12-10-15(11-13-16)20-19(21(25)30-4-2)18(23-22(26)24-20)14-31(27,28)17-8-6-5-7-9-17/h5-14,19-20H,3-4H2,1-2H3,(H2,23,24,26)/b18-14-/t19-,20+/m1/s1