4-(4-propan-2-ylphenyl)sulfanylbutanenitrile

Systemtic Name: 4-(4-propan-2-ylphenyl)sulfanylbutanenitrile Openeye Name: 4-(4-isopropylphenyl)sulfanylbutanenitrile CAS Name: 4-[(4-propan-2-ylphenyl)thio]butanenitrile IUPAC Name: 4-(4-propan-2-ylphenyl)sulfanylbutanenitrile Traditional Name: 4-(p-cumenylthio)butyronitrile Formula: C13H17NS MolecularWeight: 219.34578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NS/c1-11(2)12-5-7-13(8-6-12)15-10-4-3-9-14/h5-8,11H,3-4,10H2,1-2H3