Structure Information
Structure

Compound Identification

SMILES

CCN(CC)C1=NC=CC(=N1)C1=CC=C(OCC2COC(CN3C=CN=C3)(O2)C2=C(Cl)C=C(Cl)C=C2)C=C1

InChIKey

InChIKey=FAJSLDJADAPMKW-UHFFFAOYSA-N

Formula

C28H29Cl2N5O3

Mass

554.47

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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 - 5-phenylpyrimidine - 1,3-dichlorobenzene - Phenoxy compound - Phenol ether - Dialkylarylamine - Halobenzene - Chlorobenzene - Alkyl aryl ether - Aminopyrimidine - Ketal - N-substituted imidazole - Monocyclic benzene moiety - Benzenoid - Aryl chloride - Aryl halide - Meta-dioxolane - Imidazole - Azole - Heteroaromatic compound - Acetal - Oxacycle - Azacycle - Ether - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organopnictogen compound - Organohalogen 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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