Compound Identification
SMILES
FC(F)(F)C1=C(Cl)C(Cl)=CC(=C1)C1(CC(=NO1)C1=CC(Br)=C(CNC(=O)C=S=NCC#N)C=C1)C(F)(F)F
InChIKey
InChIKey=UQNNAQYSPRVGDQ-UHFFFAOYSA-N
Formula
C22H13BrCl2F6N4O2S
Mass
662.23
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
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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
Dichlorobenzenes Bromobenzenes Aryl bromides Aryl chlorides Isoxazolines Carbonyl imides Secondary carboxylic acid amides Nitriles Oxacyclic compounds Azacyclic compounds Thioaldehydes Organobromides Organic oxides Alkyl fluorides Hydrocarbon derivatives Organofluorides Carbonyl compounds Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - 1,2-dichlorobenzene - Bromobenzene - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Isoxazoline - Carbonyl imide - Carboxamide group - Secondary carboxylic acid amide - Oxacycle - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Thioaldehyde - Carbonitrile - Nitrile - Cyanide - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organohalogen compound - Organobromide - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen 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