ethyl 4-[[4-(2-methoxy-4,5-dimethyl-phenyl)sulfonyloxyphenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[[4-(2-methoxy-4,5-dimethyl-phenyl)sulfonyloxyphenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-(2-methoxy-4,5-dimethyl-phenyl)sulfonyloxyanilino]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[4-(2-methoxy-4,5-dimethylphenyl)sulfonyloxyanilino]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(2-methoxy-4,5-dimethylphenyl)sulfonyloxyanilino]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[4-(2-methoxy-4,5-dimethyl-phenyl)sulfonyloxyanilino]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C23H25N3O6S2 MolecularWeight: 503.5911

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=CC=C(C=C2)OS(=O)(=O)C3=C(C=C(C(=C3)C)C)OC)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=CC=C(C=C2)OS(=O)(=O)C3=C(C=C(C(=C3)C)C)OC)SC

InChI

InChI=1S/C23H25N3O6S2/c1-6-31-22(27)18-13-24-23(33-5)26-21(18)25-16-7-9-17(10-8-16)32-34(28,29)20-12-15(3)14(2)11-19(20)30-4/h7-13H,6H2,1-5H3,(H,24,25,26)