4-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]sulfamoyl]benzoic acid

Systemtic Name: 4-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]sulfamoyl]benzoic acid Openeye Name: 4-[(1-benzylpyrazol-4-yl)methyl-methyl-sulfamoyl]benzoic acid CAS Name: 4-[methyl-[[1-(phenylmethyl)-4-pyrazolyl]methyl]sulfamoyl]benzoic acid IUPAC Name: 4-[(1-benzylpyrazol-4-yl)methyl-methylsulfamoyl]benzoic acid Traditional Name: 4-[(1-benzylpyrazol-4-yl)methyl-methyl-sulfamoyl]benzoic acid Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H19N3O4S/c1-21(27(25,26)18-9-7-17(8-10-18)19(23)24)12-16-11-20-22(14-16)13-15-5-3-2-4-6-15/h2-11,14H,12-13H2,1H3,(H,23,24)