Structure Information
Structure

Compound Identification

SMILES

CCOP(=O)(COCCNC1=C(C=O)C(Cl)=NC(N)=N1)OCC

InChIKey

InChIKey=CDLQYPINKGAWGF-UHFFFAOYSA-N

Formula

C12H20ClN4O5P

Mass

366.74

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Halopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aminopyrimidine - Halopyrimidine - Aryl-aldehyde - Phosphonic acid diester - Dialkyl alkylphosphonate - Aryl chloride - Aryl halide - Phosphonic acid ester - Imidolactam - Vinylogous halide - Heteroaromatic compound - Vinylogous amide - Organophosphonic acid derivative - Azacycle - Organic oxide - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organic nitrogen compound - Organohalogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Aldehyde - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as halopyrimidines. These are aromatic compounds containing a halogen atom linked to a pyrimidine ring. 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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