ethyl 4-[[3-(dimethylsulfamoyloxy)phenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[[3-(dimethylsulfamoyloxy)phenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[3-(dimethylsulfamoyloxy)anilino]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[3-(dimethylsulfamoyloxy)anilino]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(dimethylsulfamoyloxy)anilino]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[3-(dimethylsulfamoyloxy)anilino]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C16H20N4O5S2 MolecularWeight: 412.4838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O5S2/c1-5-24-15(21)13-10-17-16(26-4)19-14(13)18-11-7-6-8-12(9-11)25-27(22,23)20(2)3/h6-10H,5H2,1-4H3,(H,17,18,19)