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Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=O)C2=NC(C=NC3=CC=C(Cl)C=C3)=CN=C2N1

InChIKey

InChIKey=WJOHKSLRCVLILZ-UHFFFAOYSA-N

Formula

C13H9ClN6O

Mass

300.71

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pteridines and derivatives

Subclass

Pterins and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Pterins and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pterin - Aminopyrimidine - Chlorobenzene - Halobenzene - Pyrimidone - Benzenoid - Pyrimidine - Pyrazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Shiff base - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Aldimine - Organic oxygen compound - Organochloride - Organohalogen compound - Imine - Organonitrogen compound - Amine - Organooxygen compound - Primary amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pterins and derivatives. These are polycyclic aromatic compounds containing a pterin moiety, which consist of a pteridine ring bearing a ketone and an amine group to form 2-aminopteridin-4(3H)-one.

External Descriptors

Not available

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