2-[4-[(2-methylsulfanylphenyl)sulfamoyl]pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(2-methylsulfanylphenyl)sulfamoyl]pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-[(2-methylsulfanylphenyl)sulfamoyl]pyrazol-1-yl]acetic acid CAS Name: 2-[4-[[2-(methylthio)phenyl]sulfamoyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-[(2-methylsulfanylphenyl)sulfamoyl]pyrazol-1-yl]acetic acid Traditional Name: 2-[4-[[2-(methylthio)phenyl]sulfamoyl]pyrazol-1-yl]acetic acid Formula: C12H13N3O4S2 MolecularWeight: 327.37932

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NS(=O)(=O)C2=CN(N=C2)CC(=O)O

Isomeric SMILES

CSC1=CC=CC=C1NS(=O)(=O)C2=CN(N=C2)CC(=O)O

InChI

InChI=1S/C12H13N3O4S2/c1-20-11-5-3-2-4-10(11)14-21(18,19)9-6-13-15(7-9)8-12(16)17/h2-7,14H,8H2,1H3,(H,16,17)