Structure Information
Structure

Compound Identification

SMILES

[Cl-].CC1=[N+](C=C(N1CCBr)[N+]([O-])=O)C1N=C(C2=CC=CC=C2Cl)C2=C(NC1=O)C=CC(Cl)=C2

InChIKey

InChIKey=ZVURRMYWEWSKFT-UHFFFAOYSA-N

Formula

C21H17BrCl3N5O3

Mass

573.65

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodiazepines

Subclass

1,4-benzodiazepines

Intermediate Tree Nodes

Not available

Direct Parent

1,4-benzodiazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1,4-benzodiazepine - Alpha-amino acid or derivatives - 1,2,4-trisubstituted-imidazole - Nitroaromatic compound - 1,2,5-trisubstituted-imidazole - Trisubstituted imidazole - Nitroimidazole - Halobenzene - Chlorobenzene - Monocyclic benzene moiety - N-substituted imidazole - Aryl chloride - Benzenoid - Aryl halide - Azole - Imidazole - Heteroaromatic compound - Secondary carboxylic acid amide - Ketimine - Lactam - Carboxamide group - C-nitro compound - Organic nitro compound - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organohalogen compound - Imine - Organic zwitterion - Organic oxide - Alkyl halide - Alkyl bromide - Organic oxygen compound - Carbonyl group - Organic salt - Organic chloride salt - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organobromide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1,4-benzodiazepines. These are organic compounds containing a benzene ring fused to a 1,4-azepine.

External Descriptors

Not available

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