2-[2-(phenylsulfanylmethyl)phenyl]ethanenitrile

Systemtic Name: 2-[2-(phenylsulfanylmethyl)phenyl]ethanenitrile Openeye Name: 2-[2-(phenylsulfanylmethyl)phenyl]acetonitrile CAS Name: 2-[2-[(phenylthio)methyl]phenyl]acetonitrile IUPAC Name: 2-[2-(phenylsulfanylmethyl)phenyl]acetonitrile Traditional Name: 2-[2-[(phenylthio)methyl]phenyl]acetonitrile Formula: C15H13NS MolecularWeight: 239.33542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC2=CC=CC=C2CC#N

Isomeric SMILES

C1=CC=C(C=C1)SCC2=CC=CC=C2CC#N

InChI

InChI=1S/C15H13NS/c16-11-10-13-6-4-5-7-14(13)12-17-15-8-2-1-3-9-15/h1-9H,10,12H2