disodium [5-methyl-1-(2-oxidanidyloxyethyl)-3-sulfanidyl-1,2,4-triazolidin-4-yl]methanesulfonate

Systemtic Name: disodium [5-methyl-1-(2-oxidanidyloxyethyl)-3-sulfanidyl-1,2,4-triazolidin-4-yl]methanesulfonate Openeye Name: disodium [5-methyl-1-(2-oxidooxyethyl)-3-sulfido-1,2,4-triazolidin-4-yl]methanesulfonate CAS Name: disodium [5-methyl-1-(2-oxidooxyethyl)-3-sulfido-1,2,4-triazolidin-4-yl]methanesulfonate IUPAC Name: disodium [5-methyl-1-(2-oxidooxyethyl)-3-sulfido-1,2,4-triazolidin-4-yl]methanesulfonate Traditional Name: disodium [5-methyl-1-(2-oxidooxyethyl)-3-sulfido-1,2,4-triazolidin-4-yl]methanesulfonate Formula: C6H12N3Na2O5S2- MolecularWeight: 316.28612

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Descriptors Computed from Structure

Canonical SMILES:

CC1N(NC(N1CS(=O)(=O)[O-])[S-])CCO[O-].[Na+].[Na+]

Isomeric SMILES

CC1N(NC(N1CS(=O)(=O)[O-])[S-])CCO[O-].[Na+].[Na+]

InChI

InChI=1S/C6H15N3O5S2.2Na/c1-5-8(4-16(11,12)13)6(15)7-9(5)2-3-14-10;;/h5-7,10,15H,2-4H2,1H3,(H,11,12,13);;/q;2*+1/p-3