Structure Information
Structure

Compound Identification

SMILES

CN1C2=C(N(CCSC3=NC=CC=N3)C(=N2)N2CCC(CC2)C(N)=O)C(=O)NC1=O

InChIKey

InChIKey=VJGWDFDTUGOACK-UHFFFAOYSA-N

Formula

C18H22N8O3S

Mass

430.49

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 - Purinone - Piperidinecarboxamide - Alkaloid or derivatives - Aryl thioether - Dialkylarylamine - Alkylarylthioether - Pyrimidone - Aminoimidazole - N-substituted imidazole - Piperidine - Pyrimidine - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Primary carboxylic acid amide - Urea - Carboxamide group - Lactam - Azacycle - Thioether - Sulfenyl compound - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen 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

Previous Back Next