Compound Identification
SMILES
CC1=CC2=C(C=C1C)N=C(NC1=NC(=O)C(CC(O)=O)=C(N1)C(F)(F)F)N2
InChIKey
InChIKey=YJTUIHBIRCVSQL-UHFFFAOYSA-N
Formula
C16H14F3N5O3
Mass
381.315
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
Pyrimidones Aminopyrimidines and derivatives Aminoimidazoles Benzenoids Hydropyrimidines Vinylogous amides Heteroaromatic compounds Amino acids Secondary amines Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Alkyl fluorides Organofluorides Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Aminopyrimidine - Pyrimidone - Aminoimidazole - Hydropyrimidine - Pyrimidine - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Amino acid - Azacycle - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Alkyl halide - Organohalogen compound - Organofluoride - Carbonyl group - Organic oxide - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen 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