4-methylsulfanyl-2-phenyl-butanenitrile

Systemtic Name: 4-methylsulfanyl-2-phenyl-butanenitrile Openeye Name: 4-methylsulfanyl-2-phenyl-butanenitrile CAS Name: 4-(methylthio)-2-phenylbutanenitrile IUPAC Name: 4-methylsulfanyl-2-phenylbutanenitrile Traditional Name: 4-(methylthio)-2-phenyl-butyronitrile Formula: C11H13NS MolecularWeight: 191.29262

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C#N)C1=CC=CC=C1

Isomeric SMILES

CSCCC(C#N)C1=CC=CC=C1

InChI

InChI=1S/C11H13NS/c1-13-8-7-11(9-12)10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3