Compound Identification
SMILES
CC1=NOC(=N1)C1=C2CN(CC3=CC=CC=C3)C(=O)C3=C(C=CC(Cl)=C3)N2C=N1
InChIKey
InChIKey=MFIUFJALHJUZHU-UHFFFAOYSA-N
Formula
C21H16ClN5O2
Mass
405.84
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
-
Class
Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
1,4-benzodiazepines
Intermediate Tree Nodes
Not available
Direct Parent
Imidazo[1,5-a][1,4]benzodiazepines
Alternative Parents
1,4-diazepines Aryl chlorides Benzene and substituted derivatives N-substituted imidazoles 1,2,4-oxadiazoles Heteroaromatic compounds Vinylogous amides Tertiary carboxylic acid amides Lactams Azacyclic compounds Oxacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Imidazo[1,5-a][1,4]benzodiazepine - Para-diazepine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - 1,2,4-oxadiazole - Heteroaromatic compound - Azole - Vinylogous amide - Tertiary carboxylic acid amide - Oxadiazole - Imidazole - Carboxamide group - Lactam - Oxacycle - Azacycle - Carboxylic acid derivative - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as imidazo[1,5-a][1,4]benzodiazepines. These are compounds containing an imidazole ring and a 1,4-benzodiazepine ring system, both sharing one nitrogen atom.
External Descriptors
Not available