4-(3-fluoranyl-4-methoxy-phenyl)-2-(phenylmethyl)-5-(4-sulfamoylphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 4-(3-fluoranyl-4-methoxy-phenyl)-2-(phenylmethyl)-5-(4-sulfamoylphenyl)pyrazole-3-carboxylic acid Openeye Name: 2-benzyl-4-(3-fluoro-4-methoxy-phenyl)-5-(4-sulfamoylphenyl)pyrazole-3-carboxylic acid CAS Name: 4-(3-fluoro-4-methoxyphenyl)-2-(phenylmethyl)-5-(4-sulfamoylphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 2-benzyl-4-(3-fluoro-4-methoxyphenyl)-5-(4-sulfamoylphenyl)pyrazole-3-carboxylic acid Traditional Name: 2-benzyl-4-(3-fluoro-4-methoxy-phenyl)-5-(4-sulfamoylphenyl)pyrazole-3-carboxylic acid Formula: C24H20FN3O5S MolecularWeight: 481.496103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)N)CC4=CC=CC=C4)C(=O)O)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)N)CC4=CC=CC=C4)C(=O)O)F

InChI

InChI=1S/C24H20FN3O5S/c1-33-20-12-9-17(13-19(20)25)21-22(16-7-10-18(11-8-16)34(26,31)32)27-28(23(21)24(29)30)14-15-5-3-2-4-6-15/h2-13H,14H2,1H3,(H,29,30)(H2,26,31,32)