Structure Information
Structure

Compound Identification

SMILES

[Cl-].CCCCOC(=O)C1=CC=CC=C1NC1=NC2=[N+](C=C1Br)C(=O)C1=CC=CC=C1N2

InChIKey

InChIKey=GRJICLGBEFYUOB-UHFFFAOYSA-N

Formula

C22H20BrClN4O3

Mass

503.78

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazanaphthalenes

Subclass

Benzodiazines

Intermediate Tree Nodes

Not available

Direct Parent

Quinazolines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoate ester - Quinazoline - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Aminopyrimidine - Halopyrimidine - Pyrimidone - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Imidolactam - Vinylogous amide - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Lactam - Azacycle - Secondary amine - Carboxylic acid derivative - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic chloride salt - Organic zwitterion - Amine - Organonitrogen compound - Organohalogen compound - Organobromide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring.

External Descriptors

Not available

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