[2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate Openeye Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid [2-keto-2-[(4-sulfamoylbenzyl)amino]ethyl] ester Formula: C19H17BrN4O5S MolecularWeight: 493.33108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)COC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)COC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br)S(=O)(=O)N

InChI

InChI=1S/C19H17BrN4O5S/c20-14-5-3-13(4-6-14)16-9-17(24-23-16)19(26)29-11-18(25)22-10-12-1-7-15(8-2-12)30(21,27)28/h1-9H,10-11H2,(H,22,25)(H,23,24)(H2,21,27,28)