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

Systemtic Name: 2-[[1-(3-fluorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanenitrile Openeye Name: 2-[1-(3-fluorophenyl)tetrazol-5-yl]sulfanylacetonitrile CAS Name: 2-[[1-(3-fluorophenyl)-5-tetrazolyl]thio]acetonitrile IUPAC Name: 2-[1-(3-fluorophenyl)tetrazol-5-yl]sulfanylacetonitrile Traditional Name: 2-[[1-(3-fluorophenyl)tetrazol-5-yl]thio]acetonitrile Formula: C9H6FN5S MolecularWeight: 235.240843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)N2C(=NN=N2)SCC#N

Isomeric SMILES

C1=CC(=CC(=C1)F)N2C(=NN=N2)SCC#N

InChI

InChI=1S/C9H6FN5S/c10-7-2-1-3-8(6-7)15-9(12-13-14-15)16-5-4-11/h1-3,6H,5H2