Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

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

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

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