Structure Information
Structure

Compound Identification

SMILES

CCCCN1C2=C(NC(CC3=CC=C(NC(C)=O)C=C3)=N2)C(=O)N(CC2=C(F)C=CC(N)=C2)C1=O

InChIKey

InChIKey=IDVZECMZGFFJAP-UHFFFAOYSA-N

Formula

C25H27FN6O3

Mass

478.528

Export to:

JSON SDF CSV

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 - Acetanilide - Purinone - N-acetylarylamine - Alkaloid or derivatives - Anilide - Aniline or substituted anilines - N-arylamide - Fluorobenzene - Halobenzene - Pyrimidone - Benzenoid - Pyrimidine - Aryl halide - Monocyclic benzene moiety - Aryl fluoride - Vinylogous amide - Acetamide - Azole - Heteroaromatic compound - Imidazole - Amino acid or derivatives - Urea - Carboxamide group - Secondary carboxylic acid amide - Lactam - Carboxylic acid derivative - Azacycle - Primary amine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen 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

Previous Back Next