Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC(=NC2=C3C(=NN12)N=C(C)C=C3C)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=HCUBZHKOLIYZSD-UHFFFAOYSA-N

Formula

C19H15ClN4O2

Mass

366.81

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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 heteropolycyclic compounds

Substituents

4-phenylpyrimidine - Pyrazolopyridine - Pyrazolo[1,5-a]pyrimidine - Pyrazolopyrimidine - Pyrimidine-6-carboxylic acid - Pyrimidine-6-carboxylic acid or derivatives - Chlorobenzene - Halobenzene - Methylpyridine - Aryl halide - Pyridine - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Methyl ester - Heteroaromatic compound - Pyrazole - Azole - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic 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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