1-(2-hydroxyethyl)-5-methyl-4-(sulfomethyl)-1,2,4-triazolidine-3-thiolate

Systemtic Name: 1-(2-hydroxyethyl)-5-methyl-4-(sulfomethyl)-1,2,4-triazolidine-3-thiolate Openeye Name: 1-(2-hydroxyethyl)-5-methyl-4-(sulfomethyl)-1,2,4-triazolidine-3-thiolate CAS Name: 1-(2-hydroxyethyl)-5-methyl-4-(sulfomethyl)-1,2,4-triazolidine-3-thiolate IUPAC Name: 1-(2-hydroxyethyl)-5-methyl-4-(sulfomethyl)-1,2,4-triazolidine-3-thiolate Traditional Name: 1-(2-hydroxyethyl)-5-methyl-4-(sulfomethyl)-1,2,4-triazolidine-3-thiolate Formula: C6H14N3O4S2- MolecularWeight: 256.32306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H15N3O4S2/c1-5-8(4-15(11,12)13)6(14)7-9(5)2-3-10/h5-7,10,14H,2-4H2,1H3,(H,11,12,13)/p-1