Compound Identification
SMILES
[Cl-].CN1C2=C(C=C(Cl)C=C2)C(=NC(N2C=C[N+](C)=C2)C1=O)C1=CC=CC=C1
InChIKey
InChIKey=AZRRQLXMFVYGTD-UHFFFAOYSA-M
Formula
C20H18Cl2N4O
Mass
401.29
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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 Aryl chlorides Benzene and substituted derivatives N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Lactams Ketimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organochlorides Hydrocarbon derivatives Carbonyl compounds Organic chloride salts Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Alpha-amino acid or derivatives - Aryl chloride - Aryl halide - N-substituted imidazole - Benzenoid - Monocyclic benzene moiety - Azole - Imidazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Lactam - Ketimine - Carboxamide group - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Imine - Organooxygen compound - Organic salt - Carbonyl group - Organic chloride salt - Hydrocarbon derivative - Organic oxide - Organic cation - 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