4-(carboxymethyl)-1,5-dimethyl-1,2,4-triazolidine-3-thiolate

Systemtic Name: 4-(carboxymethyl)-1,5-dimethyl-1,2,4-triazolidine-3-thiolate Openeye Name: 4-(carboxymethyl)-1,5-dimethyl-1,2,4-triazolidine-3-thiolate CAS Name: 4-(carboxymethyl)-1,5-dimethyl-1,2,4-triazolidine-3-thiolate IUPAC Name: 4-(carboxymethyl)-1,5-dimethyl-1,2,4-triazolidine-3-thiolate Traditional Name: 4-(carboxymethyl)-1,5-dimethyl-1,2,4-triazolidine-3-thiolate Formula: C6H12N3O2S- MolecularWeight: 190.24338

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Descriptors Computed from Structure

Canonical SMILES:

CC1N(NC(N1CC(=O)O)[S-])C

Isomeric SMILES

CC1N(NC(N1CC(=O)O)[S-])C

InChI

InChI=1S/C6H13N3O2S/c1-4-8(2)7-6(12)9(4)3-5(10)11/h4,6-7,12H,3H2,1-2H3,(H,10,11)/p-1