Compound Identification
SMILES
CC1=CC=CN2C(=O)C(C=C(C#N)C(N)=O)=C(OC3=CC=C(Br)C=C3)N=C12
InChIKey
InChIKey=LSHKJVLFZQCUDW-UHFFFAOYSA-N
Formula
C19H13BrN4O3
Mass
425.242
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 Phenoxy compounds Phenol ethers Pyrimidones Bromobenzenes Methylpyridines Aryl bromides Vinylogous esters Heteroaromatic compounds Lactams Primary carboxylic acid amides Azacyclic compounds Nitriles Organobromides Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diaryl ether - Pyridopyrimidine - Phenol ether - Phenoxy compound - Methylpyridine - Bromobenzene - Pyrimidone - Halobenzene - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Aryl bromide - Pyridine - Heteroaromatic compound - Vinylogous ester - Primary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carbonitrile - Nitrile - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organobromide - Cyanide - Organic oxide - Organohalogen 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