2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanenitrile

Systemtic Name: 2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanenitrile Openeye Name: 2-(1-tert-butyltetrazol-5-yl)sulfanylacetonitrile CAS Name: 2-[(1-tert-butyl-5-tetrazolyl)thio]acetonitrile IUPAC Name: 2-(1-tert-butyltetrazol-5-yl)sulfanylacetonitrile Traditional Name: 2-[(1-tert-butyltetrazol-5-yl)thio]acetonitrile Formula: C7H11N5S MolecularWeight: 197.26074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H11N5S/c1-7(2,3)12-6(9-10-11-12)13-5-4-8/h5H2,1-3H3