2-[[1-(2-methylpropyl)-1,2,3,4-tetrazol-5-yl]sulfonyl]ethanenitrile

Systemtic Name: 2-[[1-(2-methylpropyl)-1,2,3,4-tetrazol-5-yl]sulfonyl]ethanenitrile Openeye Name: 2-(1-isobutyltetrazol-5-yl)sulfonylacetonitrile CAS Name: 2-[[1-(2-methylpropyl)-5-tetrazolyl]sulfonyl]acetonitrile IUPAC Name: 2-[1-(2-methylpropyl)tetrazol-5-yl]sulfonylacetonitrile Traditional Name: 2-(1-isobutyltetrazol-5-yl)sulfonylacetonitrile Formula: C7H11N5O2S MolecularWeight: 229.25954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=N1)S(=O)(=O)CC#N

Isomeric SMILES

CC(C)CN1C(=NN=N1)S(=O)(=O)CC#N

InChI

InChI=1S/C7H11N5O2S/c1-6(2)5-12-7(9-10-11-12)15(13,14)4-3-8/h6H,4-5H2,1-2H3