disodium 2-[[5-(2-sulfonatoethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanesulfonate

Systemtic Name: disodium 2-[[5-(2-sulfonatoethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanesulfonate Openeye Name: disodium 2-[[5-(2-sulfonatoethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanesulfonate CAS Name: disodium 2-[[5-(2-sulfonatoethylthio)-1,3,4-thiadiazol-2-yl]thio]ethanesulfonate IUPAC Name: disodium 2-[[5-(2-sulfonatoethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanesulfonate Traditional Name: disodium 2-[[5-(2-sulfonatoethylthio)-1,3,4-thiadiazol-2-yl]thio]ethanesulfonate Formula: C6H8N2Na2O6S5 MolecularWeight: 410.44206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CS(=O)(=O)[O-])SC1=NN=C(S1)SCCS(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C(CS(=O)(=O)[O-])SC1=NN=C(S1)SCCS(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C6H10N2O6S5.2Na/c9-18(10,11)3-1-15-5-7-8-6(17-5)16-2-4-19(12,13)14;;/h1-4H2,(H,9,10,11)(H,12,13,14);;/q;2*+1/p-2