Structure Information
Structure

Compound Identification

SMILES

CN1CCN=C1C1=CC(OC2=NC(OC3=CC(C=CC3=O)=C(N)N)=NC(=C2)C2=CC=CC=C2)=CC=C1

InChIKey

InChIKey=XOUVFKQARCZKJX-UHFFFAOYSA-N

Formula

C27H24N6O3

Mass

480.528

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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 - Diaryl ether - Phenoxy compound - P-quinomethane - Phenol ether - Quinomethane - Monocyclic benzene moiety - Benzenoid - Imidolactam - 2-imidazoline - Heteroaromatic compound - Ketene acetal or derivatives - Cyclic ketone - Ketone - Azacycle - Organic 1,3-dipolar compound - Amidine - Carboxylic acid amidine - Ether - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carbonyl group - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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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