Compound Identification
SMILES
NC(=O)C1=C(N(N=N1)C1CCN2C(C1)C(=O)NC1=C(C=C(C=C1)C1=CC3=C(OCO3)C=C1)C2=O)C(N)=O
InChIKey
InChIKey=KXTYHORQMQVTQE-UHFFFAOYSA-N
Formula
C24H21N7O6
Mass
503.475
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
-
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 Benzodioxoles 2-heteroaryl carboxamides Piperidines Benzenoids Vinylogous amides Triazoles Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Primary carboxylic acid amides Lactams Oxacyclic compounds Azacyclic compounds Acetals Organonitrogen compounds Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Alpha-amino acid or derivatives - Benzodioxole - 2-heteroaryl carboxamide - Piperidine - Benzenoid - Azole - Tertiary carboxylic acid amide - 1,2,3-triazole - Vinylogous amide - Heteroaromatic compound - Carboxamide group - Lactam - Primary carboxylic acid amide - Secondary carboxylic acid amide - Azacycle - Oxacycle - Carboxylic acid derivative - Acetal - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - 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