Compound Identification
SMILES
CN(C)CC1COC2=C(O1)C=CC(NC1=NC=C3CN(C(=O)N(C)C3=N1)C1=C(F)C=CC=C1Br)=C2
InChIKey
InChIKey=KEZFPGYXJLCPAC-UHFFFAOYSA-N
Formula
C24H24BrFN6O3
Mass
543.397
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzodioxanes
- Subclass Benzo-1,4-dioxanes
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Class
Benzodioxanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxanes
Subclass
Benzo-1,4-dioxanes
Intermediate Tree Nodes
Not available
Direct Parent
Benzo-1,4-dioxanes
Alternative Parents
Pyrimidones Alkyl aryl ethers Aminopyrimidines and derivatives Fluorobenzenes Bromobenzenes Para dioxins Aryl bromides Imidolactams Aryl fluorides Heteroaromatic compounds Ureas Trialkylamines Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - Alkyl aryl ether - Aminopyrimidine - Bromobenzene - Fluorobenzene - Halobenzene - Pyrimidone - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Para-dioxin - Pyrimidine - Benzenoid - Imidolactam - Heteroaromatic compound - Urea - Tertiary aliphatic amine - Tertiary amine - Azacycle - Ether - Oxacycle - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Amine - Organofluoride - Organonitrogen compound - Organobromide - Organooxygen compound - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzo-1,4-dioxanes. These are heterocyclic compounds containing a benzene ring fused to a 1,4-dioxane ring.
External Descriptors
Not available