Compound Identification
SMILES
CCN1CCCC1CNC(=O)C1=CC2=C(C=C1)N1CC(=O)N=C3C=CC(NCCCN4CCOCC4)=CC3=C1N2
InChIKey
InChIKey=OPVFIXOXTKMLDG-UHFFFAOYSA-N
Formula
C30H39N7O3
Mass
545.688
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 Benzimidazoles Secondary alkylarylamines N-alkylpyrrolidines Morpholines Benzenoids Trialkylamines Secondary carboxylic acid amides N-acylimines Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Alpha-amino acid or derivatives - Benzimidazole - Secondary aliphatic/aromatic amine - Morpholine - Oxazinane - N-alkylpyrrolidine - Benzenoid - Pyrrolidine - Amino acid or derivatives - N-acylimine - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Secondary amine - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Amine - 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