4-(1-methylsulfanyl-1-phenyl-ethyl)benzenecarbonitrile

Systemtic Name: 4-(1-methylsulfanyl-1-phenyl-ethyl)benzenecarbonitrile Openeye Name: 4-(1-methylsulfanyl-1-phenyl-ethyl)benzonitrile CAS Name: 4-[1-(methylthio)-1-phenylethyl]benzonitrile IUPAC Name: 4-(1-methylsulfanyl-1-phenylethyl)benzonitrile Traditional Name: 4-[1-(methylthio)-1-phenyl-ethyl]benzonitrile Formula: C16H15NS MolecularWeight: 253.362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NS/c1-16(18-2,14-6-4-3-5-7-14)15-10-8-13(12-17)9-11-15/h3-11H,1-2H3