Compound Identification
SMILES
CCCOC1=CC=CC=C1C(=O)NC1=NC=C(CC2=C(C=CC(Cl)=C2)C(F)(F)F)S1
InChIKey
InChIKey=NYJHYHHGHCAFAA-UHFFFAOYSA-N
Formula
C21H18ClF3N2O2S
Mass
454.89
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
Benzamides Phenoxy compounds Phenol ethers Benzoyl derivatives 2,5-disubstituted thiazoles Alkyl aryl ethers Chlorobenzenes Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organic oxides Organonitrogen compounds Organochlorides Alkyl fluorides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Benzoic acid or derivatives - Benzamide - Phenol ether - Benzoyl - Phenoxy compound - 2,5-disubstituted 1,3-thiazole - Chlorobenzene - Halobenzene - Alkyl aryl ether - Aryl chloride - Aryl halide - Heteroaromatic compound - Azole - Thiazole - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Alkyl fluoride - Organochloride - Alkyl halide - Organohalogen 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