Compound Identification
SMILES
C[C@@]12C[C@@H]3CC4=NC5=C(C=CC(Cl)=C5)C(N)=C4[C@@H](C1)[C@H]3N2S(C)(=O)=O
InChIKey
InChIKey=GIBJSDQKBFLJLP-BUDJLTQYSA-N
Formula
C18H20ClN3O2S
Mass
377.89
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Epibatidine analogues
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Epibatidine analogues
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Epibatidine analogues
Alternative Parents
Acridines 4-aminoquinolines Chloroquinolines Indoles and derivatives Aminopyridines and derivatives Organosulfonamides Organic sulfonamides Aryl chlorides Benzenoids Sulfonyls Pyrrolidines Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acridine - Benzoquinoline - Epibatidine-skeleton - Aminoquinoline - 4-aminoquinoline - Chloroquinoline - Haloquinoline - Quinoline - Indole or derivatives - Aminopyridine - Aryl chloride - Aryl halide - Pyridine - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Sulfonyl - Pyrrolidine - Organosulfonic acid or derivatives - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organoheterocyclic compound - Azacycle - Organohalogen compound - Organic nitrogen compound - Amine - Organic oxygen compound - Organic oxide - Organosulfur compound - Primary amine - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as epibatidine analogues. These are compounds containing an epibatidine moiety, with a structure characterized by a 2-chloropyridine moiety connected to an 7-azabicyclo[2.2.1]heptane in exo position.
External Descriptors
Not available