4-[(5-bromanyl-2-methoxy-phenyl)methylsulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(5-bromanyl-2-methoxy-phenyl)methylsulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[(5-bromo-2-methoxy-phenyl)methylsulfanylmethyl]benzonitrile CAS Name: 4-[[(5-bromo-2-methoxyphenyl)methylthio]methyl]benzonitrile IUPAC Name: 4-[(5-bromo-2-methoxyphenyl)methylsulfanylmethyl]benzonitrile Traditional Name: 4-[[(5-bromo-2-methoxy-benzyl)thio]methyl]benzonitrile Formula: C16H14BrNOS MolecularWeight: 348.25746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CSCC2=CC=C(C=C2)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CSCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H14BrNOS/c1-19-16-7-6-15(17)8-14(16)11-20-10-13-4-2-12(9-18)3-5-13/h2-8H,10-11H2,1H3