Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=C(CSC2=NC(=O)NC3=C2NC=N3)C=CC(Cl)=C1

InChIKey

InChIKey=GOKUEIRMHAFVKF-UHFFFAOYSA-N

Formula

C12H8ClN5O3S

Mass

337.74

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

Purinones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

6-thiopurine - Purinone - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Pyrimidone - Alkylarylthioether - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Benzenoid - Pyrimidine - Monocyclic benzene moiety - Imidazole - Azole - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Organic zwitterion - Organochloride - Organohalogen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organosulfur 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

Previous Back Next