Compound Identification
SMILES
CN1C(NC2=CC=CC=C12)=C(C#N)C(=O)C(F)(F)Br
InChIKey
InChIKey=FTFQRYROLQYGFT-UHFFFAOYSA-N
Formula
C12H8BrF2N3O
Mass
328.117
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzimidazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzimidazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzimidazoles
Alternative Parents
Benzenoids Vinylogous amides Enones Alpha-haloketones Acryloyl compounds Ketene acetals Nitriles Azacyclic compounds Organofluorides Organobromides Organic oxides Hydrocarbon derivatives Amines Alkyl fluorides Alkyl bromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Benzenoid - Acryloyl-group - Alpha-haloketone - Enone - Vinylogous amide - Ketene acetal or derivatives - Ketone - Azacycle - Carbonitrile - Nitrile - Organic oxygen compound - Organofluoride - Organobromide - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Alkyl bromide - Amine - Hydrocarbon derivative - Organic oxide - Cyanide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).
External Descriptors
Not available