2-methyl-5-[[3-(pyrazol-1-ylmethyl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 2-methyl-5-[[3-(pyrazol-1-ylmethyl)phenyl]sulfamoyl]benzoic acid Openeye Name: 2-methyl-5-[[3-(pyrazol-1-ylmethyl)phenyl]sulfamoyl]benzoic acid CAS Name: 2-methyl-5-[[3-(1-pyrazolylmethyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 2-methyl-5-[[3-(pyrazol-1-ylmethyl)phenyl]sulfamoyl]benzoic acid Traditional Name: 2-methyl-5-[[3-(pyrazol-1-ylmethyl)phenyl]sulfamoyl]benzoic acid Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CN3C=CC=N3)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CN3C=CC=N3)C(=O)O

InChI

InChI=1S/C18H17N3O4S/c1-13-6-7-16(11-17(13)18(22)23)26(24,25)20-15-5-2-4-14(10-15)12-21-9-3-8-19-21/h2-11,20H,12H2,1H3,(H,22,23)