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
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
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Class
Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
1,4-benzodiazepines
Intermediate Tree Nodes
Not available
Direct Parent
1,4-benzodiazepines
Alternative Parents
Alpha amino acids and derivatives 1,2,4-trisubstituted imidazoles 1,2,5-trisubstituted imidazoles Nitroimidazoles Nitroaromatic compounds Chlorobenzenes Aryl chlorides N-substituted imidazoles Heteroaromatic compounds Secondary carboxylic acid amides Ketimines Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Alkyl bromides Carbonyl compounds Organochlorides Organic zwitterions Organobromides Organic oxides Hydrocarbon derivatives Organic chloride salts
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