Compound Identification
SMILES
CC1=CC=C(NC(=O)C(=CC2=C(OC3=CC=CC=C3Cl)N=C3C=CC=CN3C2=O)C#N)C=C1
InChIKey
InChIKey=TXPYWWIBKOYPOU-UHFFFAOYSA-N
Formula
C25H17ClN4O3
Mass
456.89
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
Pyridopyrimidines Anilides Phenoxy compounds Phenol ethers N-arylamides Toluenes Pyrimidones Chlorobenzenes Aryl chlorides Pyridines and derivatives Vinylogous esters Heteroaromatic compounds Lactams Secondary carboxylic acid amides Azacyclic compounds Nitriles Hydrocarbon derivatives Organochlorides Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diaryl ether - Pyridopyrimidine - Anilide - Phenoxy compound - Phenol ether - N-arylamide - Chlorobenzene - Halobenzene - Pyrimidone - Toluene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - Vinylogous ester - Carboxamide group - Secondary carboxylic acid amide - Lactam - Organoheterocyclic compound - Azacycle - Nitrile - Carbonitrile - Carboxylic acid derivative - Hydrocarbon derivative - Cyanide - Organic nitrogen compound - Organic oxide - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic 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