Structure Information
Structure

Compound Identification

SMILES

COC(=O)CCCCSC1=NC(=O)NC2=C1NC(=O)N2

InChIKey

InChIKey=CSBILALCAJUMEB-UHFFFAOYSA-N

Formula

C11H14N4O4S

Mass

298.32

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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

Purinones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Purinone - 6-thiopurine - Aryl thioether - Fatty acid ester - Alkylarylthioether - Fatty acid methyl ester - Pyrimidone - Fatty acyl - Pyrimidine - Azole - Imidazole - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Urea - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Sulfenyl compound - Thioether - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as purinones. These are purines in which the purine moiety bears a C=O group. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.

External Descriptors

Not available

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