Structure Information
Structure

Compound Identification

SMILES

CC(C)OC(=O)C1=C(COCCN)N=C2N(NC=C2C#N)C1C1=C(F)C(F)=CC=C1

InChIKey

InChIKey=MAXZLHWGLDVFNV-UHFFFAOYSA-N

Formula

C20H21F2N5O3

Mass

417.417

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrazolopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Pyrazolopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrazolopyrimidine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - Imidolactam - 1,6-dihydropyrimidine - Benzenoid - Pyrimidine - Pyrazole - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Pyrazoline - Carboxylic acid amidrazone - Amino acid or derivatives - Carboxylic acid ester - Propargyl-type 1,3-dipolar organic compound - Amidine - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic oxide - Primary amine - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Primary aliphatic amine - Cyanide - Carbonyl group - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrazolopyrimidines. These are compounds containing a pyrazolopyrimidine skeleton, which consists of a pyrazole fused to a pyrimidine. Pyrazole is 5-membered ring consisting of three carbon atoms and two adjacent nitrogen centers. Pyrimidine is 6-membered ring consisting of four carbon atoms and two adjacent nitrogen atoms at the 1- and 3- ring position.

External Descriptors

Not available

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