1-butyl-3-methyl-5-[[4-[2-(phenylcarbonylsulfamoyl)phenyl]phenyl]methyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-butyl-3-methyl-5-[[4-[2-(phenylcarbonylsulfamoyl)phenyl]phenyl]methyl]pyrazole-4-carboxylic acid Openeye Name: 5-[[4-[2-(benzoylsulfamoyl)phenyl]phenyl]methyl]-1-butyl-3-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[[4-[2-(benzoylsulfamoyl)phenyl]phenyl]methyl]-1-butyl-3-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[[4-[2-(benzoylsulfamoyl)phenyl]phenyl]methyl]-1-butyl-3-methylpyrazole-4-carboxylic acid Traditional Name: 5-[4-[2-(benzoylsulfamoyl)phenyl]benzyl]-1-butyl-3-methyl-pyrazole-4-carboxylic acid Formula: C29H29N3O5S MolecularWeight: 531.62266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C(=O)O)CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C(=O)O)CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H29N3O5S/c1-3-4-18-32-25(27(29(34)35)20(2)30-32)19-21-14-16-22(17-15-21)24-12-8-9-13-26(24)38(36,37)31-28(33)23-10-6-5-7-11-23/h5-17H,3-4,18-19H2,1-2H3,(H,31,33)(H,34,35)