2-(3-methoxyphenoxy)-6-(4-methylphenyl)sulfanyl-benzenecarbonitrile

Systemtic Name: 2-(3-methoxyphenoxy)-6-(4-methylphenyl)sulfanyl-benzenecarbonitrile Openeye Name: 2-(3-methoxyphenoxy)-6-(p-tolylsulfanyl)benzonitrile CAS Name: 2-(3-methoxyphenoxy)-6-[(4-methylphenyl)thio]benzonitrile IUPAC Name: 2-(3-methoxyphenoxy)-6-(4-methylphenyl)sulfanylbenzonitrile Traditional Name: 2-(3-methoxyphenoxy)-6-(p-tolylthio)benzonitrile Formula: C21H17NO2S MolecularWeight: 347.43018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC=CC(=C2C#N)OC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC=CC(=C2C#N)OC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H17NO2S/c1-15-9-11-18(12-10-15)25-21-8-4-7-20(19(21)14-22)24-17-6-3-5-16(13-17)23-2/h3-13H,1-2H3