methyl 6-[(2,4-dimethylphenyl)sulfonylmethyl]-4-(4-ethoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 6-[(2,4-dimethylphenyl)sulfonylmethyl]-4-(4-ethoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl 6-[(2,4-dimethylphenyl)sulfonylmethyl]-4-(4-ethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(2,4-dimethylphenyl)sulfonylmethyl]-4-(4-ethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-[(2,4-dimethylphenyl)sulfonylmethyl]-4-(4-ethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(2,4-dimethylphenyl)sulfonylmethyl]-2-keto-4-p-phenetyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O6S/c1-5-31-17-9-7-16(8-10-17)21-20(22(26)30-4)18(24-23(27)25-21)13-32(28,29)19-11-6-14(2)12-15(19)3/h6-12,21H,5,13H2,1-4H3,(H2,24,25,27)