Compound Identification
SMILES
CO[N+]1=CC=CC(CNC2=CC(=NC3=C(Br)C=NN23)N2CCC[C@H]2C(C)(C)OC)=C1
InChIKey
InChIKey=SEMYJGWRQMTSIR-KRWDZBQOSA-N
Formula
C21H28BrN6O2
Mass
476.398
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 Pyridinium derivatives Imidolactams Aryl bromides Pyrrolidines Pyrazoles Heteroaromatic compounds Dialkyl ethers Azacyclic compounds Organobromides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrazolo[1,5-a]pyrimidine - Dialkylarylamine - Aminopyrimidine - Aryl bromide - Aryl halide - Pyridine - Pyridinium - Pyrimidine - Imidolactam - Heteroaromatic compound - Azole - Pyrazole - Pyrrolidine - Azacycle - Ether - Dialkyl ether - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organic oxygen compound - Organic cation - 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