4-[3-[4-(Methylthio)phenyl]-1-oxopropyl]benzonitrile
CAS Registry Number®
898780-91-1
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CAS Name
4-[3-[4-(Methylthio)phenyl]-1-oxopropyl]benzonitrileMolecular Formula
C17H15NOSMolecular Mass
281.37Cite this Page
4-[3-[4-(Methylthio)phenyl]-1-oxopropyl]benzonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=898780-91-1 (retrieved ) (CAS RN: 898780-91-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C17H15NOS/c1-20-16-9-4-13(5-10-16)6-11-17(19)15-7-2-14(12-18)3-8-15/h2-5,7-10H,6,11H2,1H3
InChIKey
InChIKey=KSBWQPGTSQJARM-UHFFFAOYSA-N
SMILES
C(CCC1=CC=C(SC)C=C1)(=O)C2=CC=C(C#N)C=C2
Canonical SMILES
N#CC1=CC=C(C=C1)C(=O)CCC2=CC=C(SC)C=C2
Other Names for this Substance
- Benzonitrile, 4-[3-[4-(methylthio)phenyl]-1-oxopropyl]-
- 4-[3-[4-(Methylthio)phenyl]-1-oxopropyl]benzonitrile