Structure Information
Structure

Compound Identification

SMILES

CCOP(C)(=O)C(CCC1=NC(=CC(=O)N1C)C1=CC=CC=C1)P(=O)(OCC)OCC

InChIKey

InChIKey=YXAVACNSPHSTSY-UHFFFAOYSA-N

Formula

C21H32N2O6P2

Mass

470.443

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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

Phenylpyrimidines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

4-phenylpyrimidine - Dialkyl alkylphosphonate - Pyrimidone - Phosphonic acid diester - Monocyclic benzene moiety - Hydropyrimidine - Phosphonic acid ester - Benzenoid - Organophosphonic acid derivative - Heteroaromatic compound - Phosphinic acid ester - Lactam - Azacycle - Hydrocarbon derivative - Organic oxide - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrimidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrimidine ring through a CC or CN bond. 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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