Structure Information
Structure

Compound Identification

SMILES

Cl.CCCN1C2=C(NC(=N2)C2CCCCC2)C2=NC(CC3=CC=C(Br)C=C3)CN2C1=O

InChIKey

InChIKey=YZOUTCNDNRPHPF-UHFFFAOYSA-N

Formula

C23H29BrClN5O

Mass

506.87

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Imidazopyrimidines

Subclass

Purines and purine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Purinones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Purinone - Bromobenzene - Halobenzene - Pyrimidone - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Imidolactam - Heteroaromatic compound - Azole - Imidazole - 2-imidazoline - Urea - Propargyl-type 1,3-dipolar organic compound - Azacycle - Amidine - Organic 1,3-dipolar compound - Carboxylic acid amidine - Carboximidamide - Organic oxide - Hydrochloride - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as purinones. These are purines in which the purine moiety bears a C=O group. 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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