4-(4-sulfanylphenyl)benzenecarbonitrile

Systemtic Name: 4-(4-sulfanylphenyl)benzenecarbonitrile Openeye Name: 4-(4-sulfanylphenyl)benzonitrile CAS Name: 4-(4-mercaptophenyl)benzonitrile IUPAC Name: 4-(4-sulfanylphenyl)benzonitrile Traditional Name: 4-(4-mercaptophenyl)benzonitrile Formula: C13H9NS MolecularWeight: 211.28226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)S

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)S

InChI

InChI=1S/C13H9NS/c14-9-10-1-3-11(4-2-10)12-5-7-13(15)8-6-12/h1-8,15H