Structure Information
Structure

Compound Identification

SMILES

NC1=NC2=NC=C(COC(=O)C3=CC=C(C=C3)C3(N=N3)C(F)(F)F)N=C2C(N)=N1

InChIKey

InChIKey=WBMRUXMHJGIROZ-UHFFFAOYSA-N

Formula

C16H11F3N8O2

Mass

404.313

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pteridines and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Pteridines and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoate ester - Pteridine - Benzoic acid or derivatives - Benzoyl - Aminopyrimidine - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyrimidine - Pyrazine - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Diazirine - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pteridines and derivatives. These are polycyclic aromatic compounds containing a pteridine moiety, which consists of a pyrimidine fused to a pyrazine ring to form pyrimido(4,5-b)pyrazine.

External Descriptors

Not available

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