Compound Identification
SMILES
OC(=O)C1=CN(N=C1)C1=NC2=C(N1)C=C(C=C2Br)C(F)(F)F
InChIKey
InChIKey=VVGRNDJKOJCXGU-UHFFFAOYSA-N
Formula
C12H6BrF3N4O2
Mass
375.105
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
Pyrazole carboxylic acids and derivatives Benzenoids Aryl bromides Vinylogous amides Imidazoles Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organobromides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Pyrazole-4-carboxylic acid or derivatives - Aryl bromide - Aryl halide - Benzenoid - Azole - Imidazole - Pyrazole - Heteroaromatic compound - Vinylogous amide - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Alkyl halide - Organic oxide - Alkyl fluoride - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - 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