2-[3-[2-(Methylthio)phenyl]-1-oxopropyl]benzonitrile
CAS Registry Number®
898754-31-9
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CAS Name
2-[3-[2-(Methylthio)phenyl]-1-oxopropyl]benzonitrileMolecular Formula
C17H15NOSMolecular Mass
281.37Cite this Page
2-[3-[2-(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=898754-31-9 (retrieved ) (CAS RN: 898754-31-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C17H15NOS/c1-20-17-9-5-3-6-13(17)10-11-16(19)15-8-4-2-7-14(15)12-18/h2-9H,10-11H2,1H3
InChIKey
InChIKey=KPBYWJPJPDWYDV-UHFFFAOYSA-N
SMILES
C(CCC1=C(SC)C=CC=C1)(=O)C2=C(C#N)C=CC=C2
Canonical SMILES
N#CC=1C=CC=CC1C(=O)CCC=2C=CC=CC2SC
Other Names for this Substance
- Benzonitrile, 2-[3-[2-(methylthio)phenyl]-1-oxopropyl]-
- 2-[3-[2-(Methylthio)phenyl]-1-oxopropyl]benzonitrile