Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

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

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

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