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4-(3-methoxyphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-pyrimidine-1,4-dicarboxylic acid

4-(3-methoxyphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-pyrimidine-1,4-dicarboxylic acid

Systemtic Name:4-(3-methoxyphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-pyrimidine-1,4-dicarboxylic acid
Openeye Name:4-(3-methoxyphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-pyrimidine-1,4-dicarboxylic acid
CAS Name:4-(3-methoxyphenyl)-2-[(4-methoxyphenyl)methylthio]-6-methylpyrimidine-1,4-dicarboxylic acid
IUPAC Name:4-(3-methoxyphenyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methylpyrimidine-1,4-dicarboxylic acid
Traditional Name:4-(3-methoxyphenyl)-6-methyl-2-(p-anisylthio)pyrimidine-1,4-dicarboxylic acid
Formula: C22H22N2O6S
MolecularWeight: 442.48488
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N=C(N1C(=O)O)SCC2=CC=C(C=C2)OC)(C3=CC(=CC=C3)OC)C(=O)O


Isomeric SMILES

CC1=CC(N=C(N1C(=O)O)SCC2=CC=C(C=C2)OC)(C3=CC(=CC=C3)OC)C(=O)O


InChI

InChI=1S/C22H22N2O6S/c1-14-12-22(19(25)26,16-5-4-6-18(11-16)30-3)23-20(24(14)21(27)28)31-13-15-7-9-17(29-2)10-8-15/h4-12H,13H2,1-3H3,(H,25,26)(H,27,28)


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