3-(2-butylsulfanylethoxy)benzenecarbonitrile

Systemtic Name: 3-(2-butylsulfanylethoxy)benzenecarbonitrile Openeye Name: 3-(2-butylsulfanylethoxy)benzonitrile CAS Name: 3-[2-(butylthio)ethoxy]benzonitrile IUPAC Name: 3-(2-butylsulfanylethoxy)benzonitrile Traditional Name: 3-[2-(butylthio)ethoxy]benzonitrile Formula: C13H17NOS MolecularWeight: 235.34518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCOC1=CC=CC(=C1)C#N

Isomeric SMILES

CCCCSCCOC1=CC=CC(=C1)C#N

InChI

InChI=1S/C13H17NOS/c1-2-3-8-16-9-7-15-13-6-4-5-12(10-13)11-14/h4-6,10H,2-3,7-9H2,1H3