Structure Information
Structure

Compound Identification

SMILES

CCCCN1C2=C(NC(CC3=CC=C(NS(=O)(=O)C4=CN(C)C=N4)C=C3)=N2)C(=O)N(CC2=CC=CC=C2F)C1=O

InChIKey

InChIKey=OWJCXBGUTOMZTE-UHFFFAOYSA-N

Formula

C27H28FN7O4S

Mass

565.62

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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 - Sulfanilide - Alkaloid or derivatives - Fluorobenzene - Halobenzene - Pyrimidone - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Pyrimidine - Organosulfonic acid amide - Benzenoid - Organic sulfonic acid or derivatives - Heteroaromatic compound - Azole - Aminosulfonyl compound - Vinylogous amide - Sulfonyl - Organosulfonic acid or derivatives - Imidazole - Urea - Lactam - Azacycle - Organic oxygen compound - Organohalogen compound - Organic oxide - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur 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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