Structure Information
Structure

Compound Identification

SMILES

COC1=C(OCC(=O)NC2=C(F)C=C(Br)C=C2)C=CC(=C1)C1CC(=O)N=C2N=CNN12

InChIKey

InChIKey=LCHIYMRWDYFUMD-UHFFFAOYSA-N

Formula

C20H17BrFN5O4

Mass

490.289

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Triazolopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Triazolopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Triazolopyrimidine - Anilide - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - N-arylamide - Alkyl aryl ether - Halobenzene - Fluorobenzene - Pyrimidone - Bromobenzene - 1,4,5,6-tetrahydropyrimidine - Hydropyrimidine - Aryl bromide - Pyrimidine - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Triazoline - Secondary carboxylic acid amide - Carboxylic acid amidrazone - N-acylimine - Carboxamide group - Amidine - Formamidine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Imine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as triazolopyrimidines. These are polycyclic aromatic compounds containing triazole ring fused to a pyrimidine ring. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. 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

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