Compound Identification
SMILES
COC1=C(C)C(CC2=CN(CCCO)C3=C2N=C(N)N=C3Cl)=NC=C1C
InChIKey
InChIKey=BGGOOQQPRPIRBO-UHFFFAOYSA-N
Formula
C18H22ClN5O2
Mass
375.86
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
Methylpyridines Halopyrimidines Aminopyrimidines and derivatives Alkyl aryl ethers Substituted pyrroles Aryl chlorides Heteroaromatic compounds Azacyclic compounds Alkanolamines Primary amines Primary alcohols Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyrimidine - Alkyl aryl ether - Aminopyrimidine - Methylpyridine - Halopyrimidine - Aryl chloride - Aryl halide - Pyridine - Pyrimidine - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Azacycle - Alkanolamine - Ether - Organic nitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Alcohol - Amine - Primary alcohol - Primary amine - Organic oxygen 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