Compound Identification
SMILES
FC(F)(F)C1=CC=CC(=C1)C1=CC=C(O1)C=C(C#N)C1=NC(=CS1)C1=CC=C(Br)C=C1
InChIKey
InChIKey=OHVAVNJSQCOVMP-UHFFFAOYSA-N
Formula
C23H12BrF3N2OS
Mass
501.32
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
Bromobenzenes 2,4-disubstituted thiazoles Aryl bromides Heteroaromatic compounds Furans Oxacyclic compounds Nitriles Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organofluorides Organobromides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - 2,4-disubstituted 1,3-thiazole - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Azole - Furan - Thiazole - Heteroaromatic compound - Oxacycle - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Alkyl halide - Organohalogen compound - Organobromide - Organofluoride - Hydrocarbon derivative - Alkyl fluoride - Cyanide - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - 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