Compound Identification
SMILES
OC(=O)C(F)(F)F.N#CC1=CC=CC=C1C1=NC(=CC=C1)C1=CN=C2N=C(CN3C=NC=N3)C=CN12
InChIKey
InChIKey=DZBCNVUTAGKOPH-UHFFFAOYSA-N
Formula
C23H15F3N8O2
Mass
492.422
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
- Subclass Phenylpyridines
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Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Phenylpyridines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyridines
Alternative Parents
Imidazo[1,2-a]pyrimidines Benzonitriles Pyrimidines and pyrimidine derivatives N-substituted imidazoles Triazoles Alpha-halocarboxylic acids Heteroaromatic compounds Azacyclic compounds Nitriles Monocarboxylic acids and derivatives Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Not available
Substituents
2-phenylpyridine - Imidazo[1,2-a]pyrimidine - Benzonitrile - N-substituted imidazole - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Alpha-halocarboxylic acid - Imidazole - Alpha-halocarboxylic acid or derivatives - Azole - 1,2,4-triazole - Heteroaromatic compound - Carboxylic acid derivative - Nitrile - Monocarboxylic acid or derivatives - Carbonitrile - Carboxylic acid - Azacycle - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
External Descriptors
Not available