ethyl 5-[butylcarbamoyl(quinolin-2-yl)sulfamoyl]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[butylcarbamoyl(quinolin-2-yl)sulfamoyl]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[butylcarbamoyl(2-quinolyl)sulfamoyl]-1H-pyrazole-4-carboxylate CAS Name: 5-[[butylamino(oxo)methyl]-(2-quinolinyl)sulfamoyl]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[butylcarbamoyl(quinolin-2-yl)sulfamoyl]-1H-pyrazole-4-carboxylate Traditional Name: 5-[butylcarbamoyl(2-quinolyl)sulfamoyl]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C20H23N5O5S MolecularWeight: 445.49212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(C1=NC2=CC=CC=C2C=C1)S(=O)(=O)C3=C(C=NN3)C(=O)OCC

Isomeric SMILES

CCCCNC(=O)N(C1=NC2=CC=CC=C2C=C1)S(=O)(=O)C3=C(C=NN3)C(=O)OCC

InChI

InChI=1S/C20H23N5O5S/c1-3-5-12-21-20(27)25(17-11-10-14-8-6-7-9-16(14)23-17)31(28,29)18-15(13-22-24-18)19(26)30-4-2/h6-11,13H,3-5,12H2,1-2H3,(H,21,27)(H,22,24)