3-[(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)methyl]benzenecarbonitrile Openeye Name: 3-[[5-(2-thienyl)tetrazol-2-yl]methyl]benzonitrile CAS Name: 3-[(5-thiophen-2-yl-2-tetrazolyl)methyl]benzonitrile IUPAC Name: 3-[(5-thiophen-2-yltetrazol-2-yl)methyl]benzonitrile Traditional Name: 3-[[5-(2-thienyl)tetrazol-2-yl]methyl]benzonitrile Formula: C13H9N5S MolecularWeight: 267.30906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2N=C(N=N2)C3=CC=CS3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CN2N=C(N=N2)C3=CC=CS3)C#N

InChI

InChI=1S/C13H9N5S/c14-8-10-3-1-4-11(7-10)9-18-16-13(15-17-18)12-5-2-6-19-12/h1-7H,9H2