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

Systemtic Name: 2-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[1-(4-chlorophenyl)-5-tetrazolyl]thio]methyl]benzonitrile IUPAC Name: 2-[[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[1-(4-chlorophenyl)tetrazol-5-yl]thio]methyl]benzonitrile Formula: C15H10ClN5S MolecularWeight: 327.7914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10ClN5S/c16-13-5-7-14(8-6-13)21-15(18-19-20-21)22-10-12-4-2-1-3-11(12)9-17/h1-8H,10H2