Compound Identification
SMILES
O=C1N=C2C=CC(NC3CC3)=CC2=C2NC3=C(C=CC(=C3)N3CCCC3)N2C1C1=CC=CC=C1
InChIKey
InChIKey=HLBVAIUVHGBOQP-UHFFFAOYSA-N
Formula
C28H27N5O
Mass
449.558
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 Dialkylarylamines Secondary alkylarylamines Benzene and substituted derivatives Pyrrolidines N-acylimines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Alpha-amino acid or derivatives - Benzimidazole - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Pyrrolidine - Amino acid or derivatives - N-acylimine - Tertiary amine - Carboxylic acid derivative - Azacycle - Secondary amine - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Amine - Organic oxygen 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