2-[[1-(1-azanyl-1-oxidanylidene-propan-2-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[1-(1-azanyl-1-oxidanylidene-propan-2-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoic acid Openeye Name: 2-[1-(2-amino-1-methyl-2-oxo-ethyl)tetrazol-5-yl]sulfanylacetic acid CAS Name: 2-[[1-(1-amino-1-oxopropan-2-yl)-5-tetrazolyl]thio]acetic acid IUPAC Name: 2-[1-(1-amino-1-oxopropan-2-yl)tetrazol-5-yl]sulfanylacetic acid Traditional Name: 2-[[1-(2-amino-2-keto-1-methyl-ethyl)tetrazol-5-yl]thio]acetic acid Formula: C6H9N5O3S MolecularWeight: 231.23236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)N1C(=NN=N1)SCC(=O)O

Isomeric SMILES

CC(C(=O)N)N1C(=NN=N1)SCC(=O)O

InChI

InChI=1S/C6H9N5O3S/c1-3(5(7)14)11-6(8-9-10-11)15-2-4(12)13/h3H,2H2,1H3,(H2,7,14)(H,12,13)