[3-sulfanyl-1-(trioxidanylsulfanylmethyl)-1,2,4-triazolidin-4-yl]methanesulfonic acid

Systemtic Name: [3-sulfanyl-1-(trioxidanylsulfanylmethyl)-1,2,4-triazolidin-4-yl]methanesulfonic acid Openeye Name: [3-sulfanyl-1-(trioxidanylsulfanylmethyl)-1,2,4-triazolidin-4-yl]methanesulfonic acid CAS Name: [3-mercapto-1-[(trioxidanylthio)methyl]-1,2,4-triazolidin-4-yl]methanesulfonic acid IUPAC Name: [3-sulfanyl-1-(trioxidanylsulfanylmethyl)-1,2,4-triazolidin-4-yl]methanesulfonic acid Traditional Name: [3-mercapto-1-[(trioxidanylthio)methyl]-1,2,4-triazolidin-4-yl]methanesulfonic acid Formula: C4H11N3O6S3 MolecularWeight: 293.34164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1N(NC(N1CS(=O)(=O)O)S)CSOOO

Isomeric SMILES

C1N(NC(N1CS(=O)(=O)O)S)CSOOO

InChI

InChI=1S/C4H11N3O6S3/c8-12-13-15-2-7-1-6(4(14)5-7)3-16(9,10)11/h4-5,8,14H,1-3H2,(H,9,10,11)