2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanenitrile

Systemtic Name: 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanenitrile Openeye Name: 2-(1-phenyltetrazol-5-yl)sulfanylpropanenitrile CAS Name: 2-[(1-phenyl-5-tetrazolyl)thio]propanenitrile IUPAC Name: 2-(1-phenyltetrazol-5-yl)sulfanylpropanenitrile Traditional Name: 2-[(1-phenyltetrazol-5-yl)thio]propionitrile Formula: C10H9N5S MolecularWeight: 231.27696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NN=NN1C2=CC=CC=C2

Isomeric SMILES

CC(C#N)SC1=NN=NN1C2=CC=CC=C2

InChI

InChI=1S/C10H9N5S/c1-8(7-11)16-10-12-13-14-15(10)9-5-3-2-4-6-9/h2-6,8H,1H3