Compound Identification
SMILES
NCCCCC1=C(NC2=C(Br)C=C(Cl)C=C12)C1=CC2=CC=CC=C2N=C1
InChIKey
InChIKey=JPYXCLVNEHUVLW-UHFFFAOYSA-N
Formula
C21H19BrClN3
Mass
428.76
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Quinolines and derivatives
Alternative Parents
3-alkylindoles Aralkylamines Substituted pyrroles Pyridines and derivatives Benzenoids Aryl chlorides Aryl bromides Heteroaromatic compounds Azacyclic compounds Organochlorides Organobromides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline - 3-alkylindole - Indole - Indole or derivatives - Aralkylamine - Aryl bromide - Aryl chloride - Aryl halide - Pyridine - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Azacycle - Primary amine - Organonitrogen compound - Organochloride - Organobromide - Organohalogen compound - Primary aliphatic amine - Hydrocarbon derivative - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinolines and derivatives. These are compounds containing a quinoline moiety, which consists of a benzene ring fused to a pyrimidine ring to form benzo[b]azabenzene.
External Descriptors
Not available