2-(4-methylphenyl)sulfanyl-2-[3-(phenylcarbonyl)phenyl]ethanenitrile

Systemtic Name: 2-(4-methylphenyl)sulfanyl-2-[3-(phenylcarbonyl)phenyl]ethanenitrile Openeye Name: 2-(3-benzoylphenyl)-2-(p-tolylsulfanyl)acetonitrile CAS Name: 2-(3-benzoylphenyl)-2-[(4-methylphenyl)thio]acetonitrile IUPAC Name: 2-(3-benzoylphenyl)-2-(4-methylphenyl)sulfanylacetonitrile Traditional Name: 2-(3-benzoylphenyl)-2-(p-tolylthio)acetonitrile Formula: C22H17NOS MolecularWeight: 343.44148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C#N)C2=CC=CC(=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SC(C#N)C2=CC=CC(=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H17NOS/c1-16-10-12-20(13-11-16)25-21(15-23)18-8-5-9-19(14-18)22(24)17-6-3-2-4-7-17/h2-14,21H,1H3