Compound Identification
SMILES
OC1(CC(=NN1C(=O)C1=CC=C(Br)C=C1)C1=CC=NC=C1)C(F)(F)F
InChIKey
InChIKey=JRKGGFFXRAFWCC-UHFFFAOYSA-N
Formula
C16H11BrF3N3O2
Mass
414.182
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
- Subclass Pyrazolylpyridines
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Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyrazolylpyridines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrazolylpyridines
Alternative Parents
4-halobenzoic acids and derivatives Benzoyl derivatives Bromobenzenes Aryl bromides Pyrazolines Pyrazoles Heteroaromatic compounds Fluorohydrins Alkanolamines Azacyclic compounds Carboxylic acids and derivatives Organobromides Organooxygen compounds Organofluorides Organic oxides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-pyrazolylpyridine - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Pyrazoline - Pyrazole - Halohydrin - Fluorohydrin - Azacycle - Alkanolamine - Carboxylic acid derivative - Alkyl halide - Alkyl fluoride - Organohalogen compound - Organic nitrogen compound - Organic oxygen compound - Organobromide - Organic oxide - Organofluoride - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrazolylpyridines. These are compounds containing a pyrazolylpyridine skeleton, which consists of a pyrazole linked (not fused) to a pyridine by a bond.
External Descriptors
Not available