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

Systemtic Name: methyl 4-(3,4-dimethoxyphenyl)-6-[(4-methylphenyl)sulfonylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl 4-(3,4-dimethoxyphenyl)-2-oxo-6-(p-tolylsulfonylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-6-[(4-methylphenyl)sulfonylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(3,4-dimethoxyphenyl)-6-[(4-methylphenyl)sulfonylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-2-keto-6-(tosylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C22H24N2O7S MolecularWeight: 460.50016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=C(C(NC(=O)N2)C3=CC(=C(C=C3)OC)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=C(C(NC(=O)N2)C3=CC(=C(C=C3)OC)OC)C(=O)OC

InChI

InChI=1S/C22H24N2O7S/c1-13-5-8-15(9-6-13)32(27,28)12-16-19(21(25)31-4)20(24-22(26)23-16)14-7-10-17(29-2)18(11-14)30-3/h5-11,20H,12H2,1-4H3,(H2,23,24,26)