ethyl (4S)-6-[(3,4-dimethylphenyl)sulfonylmethyl]-4-(4-hydroxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-6-[(3,4-dimethylphenyl)sulfonylmethyl]-4-(4-hydroxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[(3,4-dimethylphenyl)sulfonylmethyl]-4-(4-hydroxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[(3,4-dimethylphenyl)sulfonylmethyl]-4-(4-hydroxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[(3,4-dimethylphenyl)sulfonylmethyl]-4-(4-hydroxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[(3,4-dimethylphenyl)sulfonylmethyl]-4-(4-hydroxyphenyl)-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O6S/c1-4-30-21(26)19-18(12-31(28,29)17-10-5-13(2)14(3)11-17)23-22(27)24-20(19)15-6-8-16(25)9-7-15/h5-11,20,25H,4,12H2,1-3H3,(H2,23,24,27)/t20-/m0/s1