Compound Identification
SMILES
FC(F)(F)C1=CC=CC(=C1)C1=CC=C(O1)C(=O)C(\C#N)=C1/NC(=CS1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=ICXIXKCIRLNBTL-OQKWZONESA-N
Formula
C23H12ClF3N2O2S
Mass
472.87
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 Chlorobenzenes Vinylogous thioesters Aryl chlorides Vinylogous amides Acryloyl compounds Thiazolines Thiazoles Enones Furans Heteroaromatic compounds Thioenol ethers Ketene acetals Nitriles Enamines Azacyclic compounds Oxacyclic compounds Organic oxides Organochlorides Organofluorides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Aryl ketone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Vinylogous thioester - Acryloyl-group - Enone - Furan - Thiazole - Meta-thiazoline - Vinylogous amide - Heteroaromatic compound - Thioenolether - Ketene acetal or derivatives - Ketone - Oxacycle - Azacycle - Organoheterocyclic compound - Enamine - Nitrile - Carbonitrile - Amine - Organohalogen compound - Organochloride - Organic oxide - Alkyl halide - Alkyl fluoride - Organofluoride - Cyanide - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - 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