Structure Information
Structure

Compound Identification

SMILES

CCOC1=C(Cl)C=C(C=C1)C1=CN2C(=NC3=C2C(=O)N(C)C(=O)N3C)N1CCCOC(C)C

InChIKey

InChIKey=JCLXHVQDAYLMQW-UHFFFAOYSA-N

Formula

C23H28ClN5O4

Mass

473.96

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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

Xanthines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

5-phenylimidazole - 4-phenylimidazole - Xanthine - 6-oxopurine - Purinone - Alkaloid or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Pyrimidone - N-substituted imidazole - Pyrimidine - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Azole - Heteroaromatic compound - Vinylogous amide - Imidazole - Urea - Lactam - Ether - Dialkyl ether - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as xanthines. These are purine derivatives with a ketone group conjugated at carbons 2 and 6 of the purine moiety.

External Descriptors

Not available

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