Compound Identification
SMILES
CN1C2=C(C=NC=C2)C(=NC(NC(=O)OCC2=CC=CC=C2)C1=O)C1=CC=CC=C1
InChIKey
InChIKey=KFXWFIUUNDJUCW-UHFFFAOYSA-N
Formula
C23H20N4O3
Mass
400.438
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyridodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridodiazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyridodiazepines
Alternative Parents
Benzyloxycarbonyls Alpha amino acids and derivatives Pyridines and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Carbamate esters Lactams Ketimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrido-para-diazepine - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Carbamic acid ester - Tertiary carboxylic acid amide - Carboxamide group - Ketimine - Lactam - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Imine - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridodiazepines. These are heterocyclic compounds containing a pyridine fused to a diazepine ring. Pyridine is 6-membered ring consisting of five carbon atoms and a nitrogen atom. Diazepine is a 7-membered ring consisting of five carbon atoms and two nitrogen centers.
External Descriptors
Not available