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

Systemtic Name: 2-[4-(2-methylsulfanylethylsulfamoyl)pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-(2-methylsulfanylethylsulfamoyl)pyrazol-1-yl]acetic acid CAS Name: 2-[4-[2-(methylthio)ethylsulfamoyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-(2-methylsulfanylethylsulfamoyl)pyrazol-1-yl]acetic acid Traditional Name: 2-[4-[2-(methylthio)ethylsulfamoyl]pyrazol-1-yl]acetic acid Formula: C8H13N3O4S2 MolecularWeight: 279.33652

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Descriptors Computed from Structure

Canonical SMILES:

CSCCNS(=O)(=O)C1=CN(N=C1)CC(=O)O

Isomeric SMILES

CSCCNS(=O)(=O)C1=CN(N=C1)CC(=O)O

InChI

InChI=1S/C8H13N3O4S2/c1-16-3-2-10-17(14,15)7-4-9-11(5-7)6-8(12)13/h4-5,10H,2-3,6H2,1H3,(H,12,13)