Compound Identification
SMILES
COC(=O)C1=NN2[C@@H](C1)CN([C@@H](C)C1=CC=CC=C1)C(=O)C1=CC=CC=C21
InChIKey
InChIKey=ZSQSLSTZPBLDDW-HOCLYGCPSA-N
Formula
C21H21N3O3
Mass
363.417
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
Benzene and substituted derivatives Vinylogous amides Tertiary carboxylic acid amides Pyrazolines Methyl esters N-alkylated hydrazones Lactams Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Monocyclic benzene moiety - Benzenoid - Pyrazoline - Tertiary carboxylic acid amide - Methyl ester - Vinylogous amide - N-alkylated hydrazone - Lactam - Carboxylic acid ester - Carboxamide group - Monocarboxylic acid or derivatives - Hydrazone - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - 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