Structure Information
Structure

Compound Identification

SMILES

NC1(CC2=CC(Cl)=C(Cl)C=C2)NC2=C(N=CN2CCCCCC2CNCCO2)C(=O)N1

InChIKey

InChIKey=AGYFQMLDXRNSMF-UHFFFAOYSA-N

Formula

C21H28Cl2N6O2

Mass

467.4

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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 - 2-heteroaryl carboxamide - 1,2-dichlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Chlorobenzene - N-substituted imidazole - Morpholine - Oxazinane - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Imidazole - Azole - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Lactam - Secondary carboxylic acid amide - Ortho amide - Carboxamide group - Orthocarboxylic acid derivative - Oxacycle - Azacycle - Carboxylic acid derivative - Secondary amine - Dialkyl ether - Secondary aliphatic amine - Ether - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Amine - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen 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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