Compound Identification
SMILES
CC1=CC=C(C=C1)C1=CS\C(N1)=C(/C#N)C(=O)C1=CC=C(O1)C1=CC(=CC=C1)C(F)(F)F
InChIKey
InChIKey=ZTZNMNKWHCNFNK-PTGBLXJZSA-N
Formula
C24H15F3N2O2S
Mass
452.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
Aryl ketones Toluenes Vinylogous thioesters Acryloyl compounds Vinylogous amides Enones Furans Heteroaromatic compounds Thiazoles Thiazolines Ketene acetals Thioenol ethers Enamines Nitriles Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Aryl ketone - Toluene - Vinylogous thioester - Acryloyl-group - Enone - Furan - Thiazole - Meta-thiazoline - Heteroaromatic compound - Vinylogous amide - Ketene acetal or derivatives - Ketone - Thioenolether - Organoheterocyclic compound - Azacycle - Oxacycle - Enamine - Carbonitrile - Nitrile - Alkyl halide - Organohalogen compound - Organofluoride - Organonitrogen compound - Alkyl fluoride - Organic nitrogen compound - Cyanide - Organic oxygen compound - Organooxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors
Not available