Compound Identification
SMILES
O=C1NC(=O)C(=C1C1=C2N=CNC2=CC=C1)C1=NC=CN2CCC3=CC=CC1=C23
InChIKey
InChIKey=MKJXRNLTKXPUND-UHFFFAOYSA-N
Formula
C22H15N5O2
Mass
381.395
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
Benzimidazoles Indoles and derivatives Tertiary alkylarylamines Aralkylamines Maleimides Benzenoids Imidazoles Heteroaromatic compounds Dicarboximides Pyrrolines N-unsubstituted carboxylic acid imides Amino acids and derivatives Ketimines Propargyl-type 1,3-dipolar organic compounds Enamines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Benzimidazole - Indole or derivatives - Tertiary aliphatic/aromatic amine - Maleimide - Aralkylamine - Benzenoid - Azole - Carboxylic acid imide - Dicarboximide - Imidazole - Carboxylic acid imide, n-unsubstituted - Pyrroline - Heteroaromatic compound - Tertiary amine - Amino acid or derivatives - Ketimine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Enamine - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Carbonyl group - Amine - Imine - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - 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