4-azanyl-5-(2-carboxyethyl)-1-(2-hydroxyethyl)-1,2,4-triazolidine-3-thiolate

Systemtic Name: 4-azanyl-5-(2-carboxyethyl)-1-(2-hydroxyethyl)-1,2,4-triazolidine-3-thiolate Openeye Name: 4-amino-5-(2-carboxyethyl)-1-(2-hydroxyethyl)-1,2,4-triazolidine-3-thiolate CAS Name: 4-amino-5-(2-carboxyethyl)-1-(2-hydroxyethyl)-1,2,4-triazolidine-3-thiolate IUPAC Name: 4-amino-5-(2-carboxyethyl)-1-(2-hydroxyethyl)-1,2,4-triazolidine-3-thiolate Traditional Name: 4-amino-5-(2-carboxyethyl)-1-(2-hydroxyethyl)-1,2,4-triazolidine-3-thiolate Formula: C7H15N4O3S- MolecularWeight: 235.284

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)O)C1N(NC(N1N)[S-])CCO

Isomeric SMILES

C(CC(=O)O)C1N(NC(N1N)[S-])CCO

InChI

InChI=1S/C7H16N4O3S/c8-11-5(1-2-6(13)14)10(3-4-12)9-7(11)15/h5,7,9,12,15H,1-4,8H2,(H,13,14)/p-1