ethyl 5-(butylcarbamoylsulfamoyl)-1-pyridin-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(butylcarbamoylsulfamoyl)-1-pyridin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(butylcarbamoylsulfamoyl)-1-(2-pyridyl)pyrazole-4-carboxylate CAS Name: 5-[[butylamino(oxo)methyl]sulfamoyl]-1-(2-pyridinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(butylcarbamoylsulfamoyl)-1-pyridin-2-ylpyrazole-4-carboxylate Traditional Name: 5-(butylcarbamoylsulfamoyl)-1-(2-pyridyl)pyrazole-4-carboxylic acid ethyl ester Formula: C16H21N5O5S MolecularWeight: 395.43344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=C(C=NN1C2=CC=CC=N2)C(=O)OCC

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=C(C=NN1C2=CC=CC=N2)C(=O)OCC

InChI

InChI=1S/C16H21N5O5S/c1-3-5-9-18-16(23)20-27(24,25)14-12(15(22)26-4-2)11-19-21(14)13-8-6-7-10-17-13/h6-8,10-11H,3-5,9H2,1-2H3,(H2,18,20,23)