ethyl 5-[(4,6-dimethylpyrimidin-2-yl)carbamothioylsulfamoyl]-1,3-dimethyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(4,6-dimethylpyrimidin-2-yl)carbamothioylsulfamoyl]-1,3-dimethyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(4,6-dimethylpyrimidin-2-yl)carbamothioylsulfamoyl]-1,3-dimethyl-pyrazole-4-carboxylate CAS Name: 5-[[[(4,6-dimethyl-2-pyrimidinyl)amino]-sulfanylidenemethyl]sulfamoyl]-1,3-dimethyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4,6-dimethylpyrimidin-2-yl)carbamothioylsulfamoyl]-1,3-dimethylpyrazole-4-carboxylate Traditional Name: 5-[(4,6-dimethylpyrimidin-2-yl)thiocarbamoylsulfamoyl]-1,3-dimethyl-pyrazole-4-carboxylic acid ethyl ester Formula: C15H20N6O4S2 MolecularWeight: 412.4871

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C)C)S(=O)(=O)NC(=S)NC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C)C)S(=O)(=O)NC(=S)NC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C15H20N6O4S2/c1-6-25-13(22)11-10(4)19-21(5)12(11)27(23,24)20-15(26)18-14-16-8(2)7-9(3)17-14/h7H,6H2,1-5H3,(H2,16,17,18,20,26)