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

Systemtic Name: ethyl 5-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamothioylsulfamoyl]-1,3-dimethyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamothioylsulfamoyl]-1,3-dimethyl-pyrazole-4-carboxylate CAS Name: 5-[[[(4-methoxy-6-methyl-2-pyrimidinyl)amino]-sulfanylidenemethyl]sulfamoyl]-1,3-dimethyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-methoxy-6-methylpyrimidin-2-yl)carbamothioylsulfamoyl]-1,3-dimethylpyrazole-4-carboxylate Traditional Name: 5-[(4-methoxy-6-methyl-pyrimidin-2-yl)thiocarbamoylsulfamoyl]-1,3-dimethyl-pyrazole-4-carboxylic acid ethyl ester Formula: C15H20N6O5S2 MolecularWeight: 428.4865

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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)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C15H20N6O5S2/c1-6-26-13(22)11-9(3)19-21(4)12(11)28(23,24)20-15(27)18-14-16-8(2)7-10(17-14)25-5/h7H,6H2,1-5H3,(H2,16,17,18,20,27)