2-methyl-3-[2-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)ethylamino]propanoic acid

Systemtic Name: 2-methyl-3-[2-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)ethylamino]propanoic acid Openeye Name: 2-methyl-3-[2-(5-thioxo-2H-tetrazol-1-yl)ethylamino]propanoic acid CAS Name: 2-methyl-3-[2-(5-sulfanylidene-2H-tetrazol-1-yl)ethylamino]propanoic acid IUPAC Name: 2-methyl-3-[2-(5-sulfanylidene-2H-tetrazol-1-yl)ethylamino]propanoic acid Traditional Name: 2-methyl-3-[2-(5-thioxo-2H-tetrazol-1-yl)ethylamino]propionic acid Formula: C7H13N5O2S MolecularWeight: 231.27542

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNCCN1C(=S)N=NN1)C(=O)O

Isomeric SMILES

CC(CNCCN1C(=S)N=NN1)C(=O)O

InChI

InChI=1S/C7H13N5O2S/c1-5(6(13)14)4-8-2-3-12-7(15)9-10-11-12/h5,8H,2-4H2,1H3,(H,13,14)(H,9,11,15)