4-[3-(4-Thiomorpholinylmethyl)benzoyl]benzonitrile
CAS Registry Number®
898762-88-4
CAS Name
4-[3-(4-Thiomorpholinylmethyl)benzoyl]benzonitrileMolecular Formula
C19H18N2OSMolecular Mass
322.42Cite this Page
4-[3-(4-Thiomorpholinylmethyl)benzoyl]benzonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=898762-88-4 (retrieved ) (CAS RN: 898762-88-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C19H18N2OS/c20-13-15-4-6-17(7-5-15)19(22)18-3-1-2-16(12-18)14-21-8-10-23-11-9-21/h1-7,12H,8-11,14H2
InChIKey
InChIKey=HQXUDMCIEVVXEU-UHFFFAOYSA-N
SMILES
C(=O)(C1=CC(CN2CCSCC2)=CC=C1)C3=CC=C(C#N)C=C3
Canonical SMILES
N#CC1=CC=C(C=C1)C(=O)C2=CC=CC(=C2)CN3CCSCC3
Other Names for this Substance
- Benzonitrile, 4-[3-(4-thiomorpholinylmethyl)benzoyl]-
- 4-[3-(4-Thiomorpholinylmethyl)benzoyl]benzonitrile