Compound Identification
SMILES
CONC(=O)COC1=CC2=C(NC(=O)CC(=N2)C2=CC=CC(=C2)C#N)C=C1C#CC1=CC=CC=C1
InChIKey
InChIKey=TXEZHGODXKZRBU-UHFFFAOYSA-N
Formula
C27H20N4O4
Mass
464.481
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodiazepines
Alternative Parents
Phenol ethers Benzonitriles Alkyl aryl ethers 1,4-diazepines Secondary carboxylic acid amides Lactams Ketimines Propargyl-type 1,3-dipolar organic compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Benzonitrile - Phenol ether - Para-diazepine - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Carboxamide group - Ketimine - Lactam - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carbonitrile - Nitrile - Organic oxygen compound - Organic nitrogen compound - Imine - Cyanide - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodiazepines. These are organic compounds containing a benzene ring fused to either isomers of diazepine(unsaturated seven-member heterocycle with two nitrogen atoms replacing two carbon atoms).
External Descriptors
Not available