Compound Identification
SMILES
COC(=O)C1=CC2=C(C=C1)C(=O)N(C1N=C(C3=CC=CC=C3)C3=CC(N)=CC4=C3N(CC4)C1=O)C(C)=N2
InChIKey
InChIKey=CDDVNLAUEVRDEY-UHFFFAOYSA-N
Formula
C28H23N5O4
Mass
493.523
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
Quinazolines Alpha amino acids and derivatives Indoles and derivatives Pyrimidones Benzene and substituted derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Methyl esters Lactams Ketimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Diazanaphthalene - Alpha-amino acid or derivatives - Quinazoline - Indole or derivatives - Pyrimidone - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Methyl ester - Tertiary carboxylic acid amide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Lactam - Ketimine - Propargyl-type 1,3-dipolar organic compound - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxygen compound - Imine - Organonitrogen compound - Organooxygen compound - Primary amine - Carbonyl group - Organic nitrogen compound - Amine - Organic oxide - 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