Structure Information
Structure

Compound Identification

SMILES

NC1=NC2=C(N=CN2C2CCCC2)C(SCC2=CC=CC=N2)=N1

InChIKey

InChIKey=CHQGTTKOFFXHJB-UHFFFAOYSA-N

Formula

C16H18N6S

Mass

326.42

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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

6-thiopurines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

6-thiopurine - Aryl thioether - Aminopyrimidine - Alkylarylthioether - N-substituted imidazole - Pyridine - Pyrimidine - Imidazole - Azole - Heteroaromatic compound - Sulfenyl compound - Thioether - Azacycle - Organopnictogen compound - Organic nitrogen compound - Primary amine - Organosulfur compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 6-thiopurines. These are compounds containing a purine that carries a thiol group at the 6-position. 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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