Compound Identification
SMILES
OC(=O)C1=C(N(N=C1)C1=NC(=C(Br)S1)C1=CC(=CC=C1)C(F)(F)F)C(F)(F)F
InChIKey
InChIKey=MBWLEWBGNRIGPH-UHFFFAOYSA-N
Formula
C15H6BrF6N3O2S
Mass
486.19
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
Pyrazole carboxylic acids and derivatives 2,4,5-trisubstituted thiazoles Aryl bromides Vinylogous amides Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organobromides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - 2,4,5-trisubstituted 1,3-thiazole - Pyrazole-4-carboxylic acid or derivatives - Aryl bromide - Aryl halide - Azole - Heteroaromatic compound - Pyrazole - Vinylogous amide - Thiazole - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organoheterocyclic compound - Organofluoride - Organobromide - Organohalogen compound - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Alkyl halide - 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