Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(F)(F)F.CCCCCN1C2=NN=C(N2C(=O)C2=C1N=C(Br)N2)C1=NC=CN1C

InChIKey

InChIKey=ADQBPMFYKYOHBI-UHFFFAOYSA-N

Formula

C17H18BrF3N8O3

Mass

519.283

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Imidazopyrimidines

Subclass

Purines and purine derivatives

Intermediate Tree Nodes

Purinones

Direct Parent

Hypoxanthines

Alternative Parents

Molecular Framework

Not available

Substituents

6-oxopurine - Hypoxanthine - Triazolopyrimidine - Pyrimidone - Aryl bromide - Aryl halide - N-substituted imidazole - Pyrimidine - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Triazole - 1,2,4-triazole - Lactam - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Alkyl fluoride - Carbonyl group - Alkyl halide - Organobromide - Organofluoride - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hypoxanthines. These are compounds containing the purine derivative 1H-purin-6(9H)-one. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.

External Descriptors

Not available

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