[1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(3-sulfamoylanilino)ethyl] 5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxylic acid [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] 5-chloro-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxylate Traditional Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylic acid [2-keto-1-methyl-2-(3-sulfamoylanilino)ethyl] ester Formula: C20H18ClFN4O5S MolecularWeight: 480.897123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OC(C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N)Cl)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)OC(C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N)Cl)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H18ClFN4O5S/c1-11-17(18(21)26(25-11)15-8-6-13(22)7-9-15)20(28)31-12(2)19(27)24-14-4-3-5-16(10-14)32(23,29)30/h3-10,12H,1-2H3,(H,24,27)(H2,23,29,30)