3-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-sulfamoyl]-4-methyl-benzoic acid

Systemtic Name: 3-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-sulfamoyl]-4-methyl-benzoic acid Openeye Name: 3-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-sulfamoyl]-4-methyl-benzoic acid CAS Name: 3-[(1,3-diphenyl-4-pyrazolyl)methyl-methylsulfamoyl]-4-methylbenzoic acid IUPAC Name: 3-[(1,3-diphenylpyrazol-4-yl)methyl-methylsulfamoyl]-4-methylbenzoic acid Traditional Name: 3-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-sulfamoyl]-4-methyl-benzoic acid Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O4S/c1-18-13-14-20(25(29)30)15-23(18)33(31,32)27(2)16-21-17-28(22-11-7-4-8-12-22)26-24(21)19-9-5-3-6-10-19/h3-15,17H,16H2,1-2H3,(H,29,30)