3-[[1-(3-fluorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[[1-(3-fluorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[[1-(3-fluorophenyl)tetrazol-5-yl]sulfanylmethyl]benzonitrile CAS Name: 3-[[[1-(3-fluorophenyl)-5-tetrazolyl]thio]methyl]benzonitrile IUPAC Name: 3-[[1-(3-fluorophenyl)tetrazol-5-yl]sulfanylmethyl]benzonitrile Traditional Name: 3-[[[1-(3-fluorophenyl)tetrazol-5-yl]thio]methyl]benzonitrile Formula: C15H10FN5S MolecularWeight: 311.336803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=NN=NN2C3=CC(=CC=C3)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=NN=NN2C3=CC(=CC=C3)F)C#N

InChI

InChI=1S/C15H10FN5S/c16-13-5-2-6-14(8-13)21-15(18-19-20-21)22-10-12-4-1-3-11(7-12)9-17/h1-8H,10H2