3-phenylsulfanylpropanenitrile

Systemtic Name: 3-phenylsulfanylpropanenitrile Openeye Name: 3-phenylsulfanylpropanenitrile CAS Name: 3-(phenylthio)propanenitrile IUPAC Name: 3-phenylsulfanylpropanenitrile Traditional Name: 3-(phenylthio)propionitrile Formula: C9H9NS MolecularWeight: 163.23946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC#N

Isomeric SMILES

C1=CC=C(C=C1)SCCC#N

InChI

InChI=1S/C9H9NS/c10-7-4-8-11-9-5-2-1-3-6-9/h1-3,5-6H,4,8H2