Structure Information
Structure

Compound Identification

SMILES

CCN1C2=N[C@H](CC3=CC=CC=C3)CN2C2=C(N(CC3=CC(Cl)=C(O)C=C3)C(OCC3=CC=CC=C3)=N2)C1=O

InChIKey

InChIKey=IZTKZRLNXUQDOD-HSZRJFAPSA-N

Formula

C30H28ClN5O3

Mass

542.04

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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-chlorophenol - 2-halophenol - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Halobenzene - Chlorobenzene - Imidolactam - N-substituted imidazole - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Imidazole - 2-imidazoline - Vinylogous amide - Heteroaromatic compound - Azole - Guanidine - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic oxygen compound - Amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - 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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