2-[[1-(2-methylbutan-2-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[1-(2-methylbutan-2-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: 2-[1-(1,1-dimethylpropyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-(2-methylbutan-2-yl)-5-tetrazolyl]thio]acetate IUPAC Name: 2-[1-(2-methylbutan-2-yl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[(1-tert-amyltetrazol-5-yl)thio]acetate Formula: C8H13N4O2S- MolecularWeight: 229.27942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)N1C(=NN=N1)SCC(=O)[O-]

Isomeric SMILES

CCC(C)(C)N1C(=NN=N1)SCC(=O)[O-]

InChI

InChI=1S/C8H14N4O2S/c1-4-8(2,3)12-7(9-10-11-12)15-5-6(13)14/h4-5H2,1-3H3,(H,13,14)/p-1