3-(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)propanenitrile

Systemtic Name: 3-(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)propanenitrile Openeye Name: 3-(4-phenyl-5-thioxo-tetrazol-1-yl)propanenitrile CAS Name: 3-(4-phenyl-5-sulfanylidene-1-tetrazolyl)propanenitrile IUPAC Name: 3-(4-phenyl-5-sulfanylidenetetrazol-1-yl)propanenitrile Traditional Name: 3-(4-phenyl-5-thioxo-tetrazol-1-yl)propionitrile Formula: C10H9N5S MolecularWeight: 231.27696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=S)N(N=N2)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=S)N(N=N2)CCC#N

InChI

InChI=1S/C10H9N5S/c11-7-4-8-14-10(16)15(13-12-14)9-5-2-1-3-6-9/h1-3,5-6H,4,8H2