Compound Identification
SMILES
CC(=O)NC1=NC2=C(NC=N2)C(SC(C)=O)=N1
InChIKey
InChIKey=YQDLNXOGENFDKM-UHFFFAOYSA-N
Formula
C9H9N5O2S
Mass
251.26
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Imidazopyrimidines
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Subclass
Purines and purine derivatives
- Level 5 6-thiopurines
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Subclass
Purines and purine derivatives
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Class
Imidazopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazopyrimidines
Subclass
Purines and purine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
6-thiopurines
Alternative Parents
N-acetylarylamines Aryl thioethers Pyrimidines and pyrimidine derivatives Imidazoles Heteroaromatic compounds Acetamides Thioesters Secondary carboxylic acid amides Carbothioic S-esters Sulfenyl compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
6-thiopurine - N-acetylarylamine - Aryl thioether - N-arylamide - Pyrimidine - Azole - Imidazole - Heteroaromatic compound - Acetamide - Carboxamide group - Secondary carboxylic acid amide - Carbothioic s-ester - Thiocarboxylic acid ester - Carboxylic acid derivative - Azacycle - Thiocarboxylic acid or derivatives - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - 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