2-[3,5-dimethyl-4-(thiophen-2-ylmethylsulfamoyl)pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[3,5-dimethyl-4-(thiophen-2-ylmethylsulfamoyl)pyrazol-1-yl]ethanoic acid Openeye Name: 2-[3,5-dimethyl-4-(2-thienylmethylsulfamoyl)pyrazol-1-yl]acetic acid CAS Name: 2-[3,5-dimethyl-4-(thiophen-2-ylmethylsulfamoyl)-1-pyrazolyl]acetic acid IUPAC Name: 2-[3,5-dimethyl-4-(thiophen-2-ylmethylsulfamoyl)pyrazol-1-yl]acetic acid Traditional Name: 2-[3,5-dimethyl-4-(2-thenylsulfamoyl)pyrazol-1-yl]acetic acid Formula: C12H15N3O4S2 MolecularWeight: 329.3952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)O)C)S(=O)(=O)NCC2=CC=CS2

Isomeric SMILES

CC1=C(C(=NN1CC(=O)O)C)S(=O)(=O)NCC2=CC=CS2

InChI

InChI=1S/C12H15N3O4S2/c1-8-12(9(2)15(14-8)7-11(16)17)21(18,19)13-6-10-4-3-5-20-10/h3-5,13H,6-7H2,1-2H3,(H,16,17)