Compound Identification
SMILES
COC1=CC=CC(=N1)C1CCC(CC1)C1=C2N=C3C=NNCC3=C2N(C)CC=C1Cl
InChIKey
InChIKey=WHTXEFRBPZTSQB-UHFFFAOYSA-N
Formula
C23H26ClN5O
Mass
423.95
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Azepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Azepines
Alternative Parents
Alkyl aryl ethers Pyridines and derivatives Pyridazines and derivatives Heteroaromatic compounds Trialkylamines N-alkylated hydrazones Ketimines Vinyl chlorides Propargyl-type 1,3-dipolar organic compounds Enamines Chloroalkenes Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl aryl ether - Azepine - Pyridazine - Pyridine - Heteroaromatic compound - Ketimine - Tertiary amine - Tertiary aliphatic amine - N-alkylated hydrazone - Enamine - Ether - Hydrazone - Azacycle - Chloroalkene - Haloalkene - Organic 1,3-dipolar compound - Vinyl chloride - Vinyl halide - Propargyl-type 1,3-dipolar organic compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Imine - Hydrocarbon derivative - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as azepines. These are organic compounds containing an unsaturated seven-member heterocycle with one nitrogen atom replacing a carbon atom.
External Descriptors
Not available