2-phenylsulfanyl-4-(2H-1,2,3,4-tetrazol-5-yl)benzenecarbonitrile

Systemtic Name: 2-phenylsulfanyl-4-(2H-1,2,3,4-tetrazol-5-yl)benzenecarbonitrile Openeye Name: 2-phenylsulfanyl-4-(2H-tetrazol-5-yl)benzonitrile CAS Name: 2-(phenylthio)-4-(2H-tetrazol-5-yl)benzonitrile IUPAC Name: 2-phenylsulfanyl-4-(2H-tetrazol-5-yl)benzonitrile Traditional Name: 2-(phenylthio)-4-(2H-tetrazol-5-yl)benzonitrile Formula: C14H9N5S MolecularWeight: 279.31976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(C=CC(=C2)C3=NNN=N3)C#N

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(C=CC(=C2)C3=NNN=N3)C#N

InChI

InChI=1S/C14H9N5S/c15-9-11-7-6-10(14-16-18-19-17-14)8-13(11)20-12-4-2-1-3-5-12/h1-8H,(H,16,17,18,19)