2-(3-methyl-4-phenylsulfanyl-phenyl)ethanenitrile

Systemtic Name: 2-(3-methyl-4-phenylsulfanyl-phenyl)ethanenitrile Openeye Name: 2-(3-methyl-4-phenylsulfanyl-phenyl)acetonitrile CAS Name: 2-[3-methyl-4-(phenylthio)phenyl]acetonitrile IUPAC Name: 2-(3-methyl-4-phenylsulfanylphenyl)acetonitrile Traditional Name: 2-[3-methyl-4-(phenylthio)phenyl]acetonitrile Formula: C15H13NS MolecularWeight: 239.33542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CC#N)SC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)CC#N)SC2=CC=CC=C2

InChI

InChI=1S/C15H13NS/c1-12-11-13(9-10-16)7-8-15(12)17-14-5-3-2-4-6-14/h2-8,11H,9H2,1H3