methyl 5-(butylcarbamoylsulfamoyl)-1-methyl-pyrazole-4-carboxylate

Systemtic Name: methyl 5-(butylcarbamoylsulfamoyl)-1-methyl-pyrazole-4-carboxylate Openeye Name: methyl 5-(butylcarbamoylsulfamoyl)-1-methyl-pyrazole-4-carboxylate CAS Name: 5-[[butylamino(oxo)methyl]sulfamoyl]-1-methyl-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(butylcarbamoylsulfamoyl)-1-methylpyrazole-4-carboxylate Traditional Name: 5-(butylcarbamoylsulfamoyl)-1-methyl-pyrazole-4-carboxylic acid methyl ester Formula: C11H18N4O5S MolecularWeight: 318.34942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=C(C=NN1C)C(=O)OC

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=C(C=NN1C)C(=O)OC

InChI

InChI=1S/C11H18N4O5S/c1-4-5-6-12-11(17)14-21(18,19)9-8(10(16)20-3)7-13-15(9)2/h7H,4-6H2,1-3H3,(H2,12,14,17)