Compound Identification
SMILES
OCCC1CCCCN1C1=NC2=C(Br)C=NN2C(NC(=O)OC2=CN=CC=C2)=C1
InChIKey
InChIKey=YYEMJDBENOCTFD-UHFFFAOYSA-N
Formula
C19H21BrN6O3
Mass
461.32
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrazolopyrimidines
- Subclass Pyrazolo[1,5-a]pyrimidines
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Class
Pyrazolopyrimidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrazolopyrimidines
Subclass
Pyrazolo[1,5-a]pyrimidines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrazolo[1,5-a]pyrimidines
Alternative Parents
Dialkylarylamines Aminopyrimidines and derivatives Pyridines and derivatives Piperidines Imidolactams Aryl bromides Pyrazoles Heteroaromatic compounds Carbamate esters Azacyclic compounds Primary alcohols Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrazolo[1,5-a]pyrimidine - Dialkylarylamine - Aminopyrimidine - Aryl bromide - Aryl halide - Piperidine - Pyridine - Pyrimidine - Imidolactam - Azole - Pyrazole - Heteroaromatic compound - Carbamic acid ester - Azacycle - Primary alcohol - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Carbonyl group - Alcohol - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrazolo[1,5-a]pyrimidines. These are aromatic heterocyclic compounds containing a pyrazolo[3,4-d]pyrimidine ring system, which consists of a pyrazole ring fused to and sharing exactly one nitrogen atom with a pyrimidine ring.
External Descriptors
Not available