3-(1-phenylbutylsulfanyl)propanenitrile

Systemtic Name: 3-(1-phenylbutylsulfanyl)propanenitrile Openeye Name: 3-(1-phenylbutylsulfanyl)propanenitrile CAS Name: 3-(1-phenylbutylthio)propanenitrile IUPAC Name: 3-(1-phenylbutylsulfanyl)propanenitrile Traditional Name: 3-(1-phenylbutylthio)propionitrile Formula: C13H17NS MolecularWeight: 219.34578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NS/c1-2-7-13(15-11-6-10-14)12-8-4-3-5-9-12/h3-5,8-9,13H,2,6-7,11H2,1H3