2-[4-[2-(4-methylphenyl)sulfanylethoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[2-(4-methylphenyl)sulfanylethoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[2-(p-tolylsulfanyl)ethoxy]phenyl]acetonitrile CAS Name: 2-[4-[2-[(4-methylphenyl)thio]ethoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[2-(4-methylphenyl)sulfanylethoxy]phenyl]acetonitrile Traditional Name: 2-[4-[2-(p-tolylthio)ethoxy]phenyl]acetonitrile Formula: C17H17NOS MolecularWeight: 283.38798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCOC2=CC=C(C=C2)CC#N

Isomeric SMILES

CC1=CC=C(C=C1)SCCOC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C17H17NOS/c1-14-2-8-17(9-3-14)20-13-12-19-16-6-4-15(5-7-16)10-11-18/h2-9H,10,12-13H2,1H3