Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)C1=CC(NC2=NNC(C)=C2)=NC(Cl)=C1C#N
InChIKey
InChIKey=CBPKEBGBELJKHH-UHFFFAOYSA-N
Formula
C19H18ClN5O3
Mass
399.84
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
Phenoxy compounds Methoxybenzenes 3-pyridinecarbonitriles Anisoles 2-halopyridines Aminopyridines and derivatives Alkyl aryl ethers Imidolactams Aryl chlorides Pyrazoles Heteroaromatic compounds Secondary amines Nitriles Azacyclic compounds Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-phenylpyridine - Phenoxy compound - Anisole - Phenol ether - 3-pyridinecarbonitrile - Methoxybenzene - Alkyl aryl ether - Aminopyridine - 2-halopyridine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Imidolactam - Heteroaromatic compound - Pyrazole - Azole - Azacycle - Secondary amine - Ether - Carbonitrile - Nitrile - Cyanide - Organic oxygen compound - Organooxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - 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