6-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-4,5-dihydropyrimidine-3,5-dicarboxylic acid

Systemtic Name: 6-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-4,5-dihydropyrimidine-3,5-dicarboxylic acid Openeye Name: 6-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-4,5-dihydropyrimidine-3,5-dicarboxylic acid CAS Name: 6-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylthio]-6-methyl-4,5-dihydropyrimidine-3,5-dicarboxylic acid IUPAC Name: 6-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-4,5-dihydropyrimidine-3,5-dicarboxylic acid Traditional Name: 6-(2-methoxyphenyl)-6-methyl-2-(p-anisylthio)-4,5-dihydropyrimidine-3,5-dicarboxylic acid Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CN(C(=N1)SCC2=CC=C(C=C2)OC)C(=O)O)C(=O)O)C3=CC=CC=C3OC

Isomeric SMILES

CC1(C(CN(C(=N1)SCC2=CC=C(C=C2)OC)C(=O)O)C(=O)O)C3=CC=CC=C3OC

InChI

InChI=1S/C22H24N2O6S/c1-22(16-6-4-5-7-18(16)30-3)17(19(25)26)12-24(21(27)28)20(23-22)31-13-14-8-10-15(29-2)11-9-14/h4-11,17H,12-13H2,1-3H3,(H,25,26)(H,27,28)