Structure Information
Structure

Compound Identification

SMILES

NS(=O)(=O)C1=CC=C(C=C1)N=NC1=NC2C(N1)=NC(=O)NC2=O

InChIKey

InChIKey=UXMZXUQMAGSGIM-UHFFFAOYSA-N

Formula

C11H9N7O4S

Mass

335.3

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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 - Purinone - Benzenesulfonamide - Alpha-amino acid or derivatives - 6-oxopurine - Benzenesulfonyl group - Alkaloid or derivatives - Pyrimidone - Benzenoid - Organosulfonic acid amide - Pyrimidine - 1,2,5,6-tetrahydropyrimidine - Hydropyrimidine - Monocyclic benzene moiety - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - 2-imidazoline - Dicarboximide - Carbonic acid derivative - Azo compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carboxylic acid derivative - Carboxylic acid amidine - Amidine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - 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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