[(3-chlorophenyl)amino] 5-(4-fluorophenyl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxylate

Systemtic Name: [(3-chlorophenyl)amino] 5-(4-fluorophenyl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxylate Openeye Name: (3-chloroanilino) 5-(4-fluorophenyl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxylate CAS Name: 5-(4-fluorophenyl)-1-(4-sulfamoylphenyl)-3-pyrazolecarboxylic acid (3-chloroanilino) ester IUPAC Name: (3-chloroanilino) 5-(4-fluorophenyl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxylate Traditional Name: 5-(4-fluorophenyl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxylic acid (3-chloroanilino) ester Formula: C22H16ClFN4O4S MolecularWeight: 486.903243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NOC(=O)C2=NN(C(=C2)C3=CC=C(C=C3)F)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NOC(=O)C2=NN(C(=C2)C3=CC=C(C=C3)F)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C22H16ClFN4O4S/c23-15-2-1-3-17(12-15)27-32-22(29)20-13-21(14-4-6-16(24)7-5-14)28(26-20)18-8-10-19(11-9-18)33(25,30)31/h1-13,27H,(H2,25,30,31)