Compound Identification
SMILES
COCCn1c(O)c2nc3ccccc3c2nc1SCC(=O)N1CCCCC1
InChIKey
InChIKey=XCKROSHUZZJORB-UHFFFAOYSA-N
Formula
C20H24N4O3S
Mass
400.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolopyrimidines
Alternative Parents
N-acylpiperidines Indoles Hydroxypyrimidines Alkylarylthioethers Benzenoids Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Sulfenyl compounds Dialkyl ethers Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole - Indole or derivatives - N-acyl-piperidine - Pyrrolopyrimidine - Aryl thioether - Hydroxypyrimidine - Alkylarylthioether - Piperidine - Pyrimidine - Benzenoid - Heteroaromatic compound - Pyrrole - Tertiary carboxylic acid amide - Carboxamide group - Azacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Thioether - Sulfenyl compound - Carbonyl group - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolopyrimidines. These are compounds containing a pyrrolopyrimidine moiety, which consists of a pyrrole ring fused to a pyrimidine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available