Compound Identification
SMILES
CC1=C(OC2=CC(Cl)=CC(=C2)C#N)C(CC(=O)N2CCC3=NC(N)=NC=C3C2)=NN1
InChIKey
InChIKey=PHMMLWFJIPKEKN-UHFFFAOYSA-N
Formula
C20H18ClN7O2
Mass
423.86
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
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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 Benzonitriles Phenol ethers Phenoxy compounds Aminopyrimidines and derivatives Chlorobenzenes Aryl chlorides Pyridines and derivatives Heteroaromatic compounds Pyrazoles Tertiary carboxylic acid amides Amino acids and derivatives Nitriles Azacyclic compounds Primary amines Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diaryl ether - Pyridopyrimidine - Phenoxy compound - Benzonitrile - Phenol ether - Chlorobenzene - Aminopyrimidine - Halobenzene - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Pyridine - Benzenoid - Pyrimidine - Heteroaromatic compound - Pyrazole - Tertiary carboxylic acid amide - Azole - Amino acid or derivatives - Carboxamide group - Carbonitrile - Organoheterocyclic compound - Azacycle - Nitrile - Carboxylic acid derivative - Amine - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Cyanide - Organic nitrogen 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