Compound Identification
SMILES
CC(C)C1=NN=C(CN2CC(C2)OC2=CN=C(C=C2)C2=C(F)C=C(C=C2)C(N)=O)S1
InChIKey
InChIKey=CHPQLTCXNZJGLJ-UHFFFAOYSA-N
Formula
C21H22FN5O2S
Mass
427.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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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
3-halobenzoic acids and derivatives Benzamides Benzoyl derivatives Alkyl aryl ethers Aralkylamines Fluorobenzenes Aryl fluorides Thiadiazoles Heteroaromatic compounds Azetidines Trialkylamines Primary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyridine - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Thiadiazole - Heteroaromatic compound - Azole - Tertiary aliphatic amine - Tertiary amine - Primary carboxylic acid amide - Azetidine - Carboxamide group - Amino acid or derivatives - Azacycle - Ether - Carboxylic acid derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Amine - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic 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