2-[4-[1-[(4-methylsulfanylphenyl)amino]ethyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[1-[(4-methylsulfanylphenyl)amino]ethyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[1-(4-methylsulfanylanilino)ethyl]phenoxy]acetonitrile CAS Name: 2-[4-[1-[4-(methylthio)anilino]ethyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[1-(4-methylsulfanylanilino)ethyl]phenoxy]acetonitrile Traditional Name: 2-[4-[1-[4-(methylthio)anilino]ethyl]phenoxy]acetonitrile Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OCC#N)NC2=CC=C(C=C2)SC

Isomeric SMILES

CC(C1=CC=C(C=C1)OCC#N)NC2=CC=C(C=C2)SC

InChI

InChI=1S/C17H18N2OS/c1-13(19-15-5-9-17(21-2)10-6-15)14-3-7-16(8-4-14)20-12-11-18/h3-10,13,19H,12H2,1-2H3