Structure Information
Structure

Compound Identification

SMILES

CN(C)C1=CC=C(C=NNC2=NC3=C(N2CC2=CC=C(F)C=C2)C(=O)NC(=O)N3C)C=C1

InChIKey

InChIKey=DCTVVCUBESZHHY-UHFFFAOYSA-N

Formula

C22H22FN7O2

Mass

435.463

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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

Xanthine - 6-oxopurine - Purinone - Alkaloid or derivatives - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Fluorobenzene - Halobenzene - Pyrimidone - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Pyrimidine - Benzenoid - Heteroaromatic compound - Azole - Vinylogous amide - Imidazole - Urea - Tertiary amine - Lactam - Hydrazone - Azacycle - Organic oxygen compound - Organohalogen compound - Amine - Organic nitrogen compound - Organofluoride - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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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