2-(1H-1,2,4-triazol-5-ylsulfonyl)ethanenitrile

Systemtic Name: 2-(1H-1,2,4-triazol-5-ylsulfonyl)ethanenitrile Openeye Name: 2-(1H-1,2,4-triazol-5-ylsulfonyl)acetonitrile CAS Name: 2-(1H-1,2,4-triazol-5-ylsulfonyl)acetonitrile IUPAC Name: 2-(1H-1,2,4-triazol-5-ylsulfonyl)acetonitrile Traditional Name: 2-(1H-1,2,4-triazol-5-ylsulfonyl)acetonitrile Formula: C4H4N4O2S MolecularWeight: 172.16516

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNC(=N1)S(=O)(=O)CC#N

Isomeric SMILES

C1=NNC(=N1)S(=O)(=O)CC#N

InChI

InChI=1S/C4H4N4O2S/c5-1-2-11(9,10)4-6-3-7-8-4/h3H,2H2,(H,6,7,8)