(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)methanesulfonic acid

Systemtic Name: (3-methylsulfanyl-1H-1,2,4-triazol-5-yl)methanesulfonic acid Openeye Name: (3-methylsulfanyl-1H-1,2,4-triazol-5-yl)methanesulfonic acid CAS Name: [3-(methylthio)-1H-1,2,4-triazol-5-yl]methanesulfonic acid IUPAC Name: (3-methylsulfanyl-1H-1,2,4-triazol-5-yl)methanesulfonic acid Traditional Name: [3-(methylthio)-1H-1,2,4-triazol-5-yl]methanesulfonic acid Formula: C4H7N3O3S2 MolecularWeight: 209.24668

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=N1)CS(=O)(=O)O

Isomeric SMILES

CSC1=NNC(=N1)CS(=O)(=O)O

InChI

InChI=1S/C4H7N3O3S2/c1-11-4-5-3(6-7-4)2-12(8,9)10/h2H2,1H3,(H,5,6,7)(H,8,9,10)