Compound Identification
SMILES
CC1=CC(=CC(C)=C1OC1=C(Br)C(Cl)=NC(NC2=CC=C(C=C2)C#N)=N1)C#N
InChIKey
InChIKey=ODWHQRYHASBLKO-UHFFFAOYSA-N
Formula
C20H13BrClN5O
Mass
454.71
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Ethers
- Level 5 Diarylethers
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Subclass
Ethers
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Ethers
Intermediate Tree Nodes
Not available
Direct Parent
Diarylethers
Alternative Parents
m-Xylenes Phenoxy compounds Phenol ethers Aniline and substituted anilines Benzonitriles Aminopyrimidines and derivatives Halopyrimidines Aryl bromides Aryl chlorides Heteroaromatic compounds Secondary amines Nitriles Azacyclic compounds Organochlorides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diaryl ether - Phenoxy compound - M-xylene - Xylene - Aniline or substituted anilines - Benzonitrile - Phenol ether - Aminopyrimidine - Halopyrimidine - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Secondary amine - Carbonitrile - Nitrile - Organonitrogen compound - Organic nitrogen compound - Amine - Organochloride - Cyanide - Hydrocarbon derivative - Organohalogen compound - Organobromide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as diarylethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are aryl groups.
External Descriptors
Not available