Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC(Cl)=C(NC2=COC(=N2)N2C(CC3=CC=CC=C3NC3=C(Cl)C=CC=C3Cl)=NC3=C(C=C(Br)C=C3)C2=O)C=C1

InChIKey

InChIKey=NKCUPASHWCKSGV-UHFFFAOYSA-N

Formula

C30H18BrCl3N6O4

Mass

712.77

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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

Quinazoline - Nitrobenzene - Nitroaromatic compound - 1,3-dichlorobenzene - Aniline or substituted anilines - 2,4-disubstituted 1,3-oxazole - Chlorobenzene - Halobenzene - Pyrimidone - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Primary aromatic amine - Pyrimidine - Benzenoid - Imidolactam - Azole - Heteroaromatic compound - Oxazole - Organic nitro compound - Lactam - C-nitro compound - Secondary amine - Azacycle - Oxacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic salt - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic zwitterion - Organic nitrogen compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - 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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