methyl 4-(4-chlorophenyl)-2-(cyanomethyl)-5-(4-sulfamoylphenyl)pyrazole-3-carboxylate

Systemtic Name: methyl 4-(4-chlorophenyl)-2-(cyanomethyl)-5-(4-sulfamoylphenyl)pyrazole-3-carboxylate Openeye Name: methyl 4-(4-chlorophenyl)-2-(cyanomethyl)-5-(4-sulfamoylphenyl)pyrazole-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-(cyanomethyl)-5-(4-sulfamoylphenyl)-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-chlorophenyl)-2-(cyanomethyl)-5-(4-sulfamoylphenyl)pyrazole-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-(cyanomethyl)-5-(4-sulfamoylphenyl)pyrazole-3-carboxylic acid methyl ester Formula: C19H15ClN4O4S MolecularWeight: 430.8648

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=NN1CC#N)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=C(C(=NN1CC#N)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H15ClN4O4S/c1-28-19(25)18-16(12-2-6-14(20)7-3-12)17(23-24(18)11-10-21)13-4-8-15(9-5-13)29(22,26)27/h2-9H,11H2,1H3,(H2,22,26,27)