sodium 2-(1,5-dimethyl-3-sulfanidyl-1,2,4-triazol-4-ium-4-yl)ethanesulfonate

Systemtic Name: sodium 2-(1,5-dimethyl-3-sulfanidyl-1,2,4-triazol-4-ium-4-yl)ethanesulfonate Openeye Name: sodium 2-(1,5-dimethyl-3-sulfido-1,2,4-triazol-4-ium-4-yl)ethanesulfonate CAS Name: sodium 2-(1,5-dimethyl-3-sulfido-1,2,4-triazol-4-ium-4-yl)ethanesulfonate IUPAC Name: sodium 2-(1,5-dimethyl-3-sulfido-1,2,4-triazol-4-ium-4-yl)ethanesulfonate Traditional Name: sodium 2-(1,5-dimethyl-3-sulfido-1,2,4-triazol-4-ium-4-yl)ethanesulfonate Formula: C6H10N3NaO3S2 MolecularWeight: 259.28167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=NN1C)[S-])CCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=[N+](C(=NN1C)[S-])CCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C6H11N3O3S2.Na/c1-5-8(2)7-6(13)9(5)3-4-14(10,11)12;/h3-4H2,1-2H3,(H-,7,10,11,12,13);/q;+1/p-1