3-(methylaminomethyl)-4-(4-methylsulfanylphenoxy)benzenecarbonitrile

Systemtic Name: 3-(methylaminomethyl)-4-(4-methylsulfanylphenoxy)benzenecarbonitrile Openeye Name: 3-(methylaminomethyl)-4-(4-methylsulfanylphenoxy)benzonitrile CAS Name: 3-(methylaminomethyl)-4-[4-(methylthio)phenoxy]benzonitrile IUPAC Name: 3-(methylaminomethyl)-4-(4-methylsulfanylphenoxy)benzonitrile Traditional Name: 3-(methylaminomethyl)-4-[4-(methylthio)phenoxy]benzonitrile Formula: C16H16N2OS MolecularWeight: 284.37604

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=C(C=CC(=C1)C#N)OC2=CC=C(C=C2)SC

Isomeric SMILES

CNCC1=C(C=CC(=C1)C#N)OC2=CC=C(C=C2)SC

InChI

InChI=1S/C16H16N2OS/c1-18-11-13-9-12(10-17)3-8-16(13)19-14-4-6-15(20-2)7-5-14/h3-9,18H,11H2,1-2H3