Compound Identification
SMILES
COC1=CSC(=C1)C1=CC(=CN=C1F)C1CC2CCC1N2
InChIKey
InChIKey=UOQCMXZCJMNKGW-UHFFFAOYSA-N
Formula
C16H17FN2OS
Mass
304.38
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
Pyrrolidinylpyridines Aralkylamines Alkyl aryl ethers 2-halopyridines Aryl fluorides Thiophenes Pyrrolidines Heteroaromatic compounds Dialkylamines Azacyclic compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Epibatidine-skeleton - Pyrrolidinylpyridine - Alkyl aryl ether - Aralkylamine - 2-halopyridine - Aryl fluoride - Aryl halide - Pyridine - Heteroaromatic compound - Thiophene - Pyrrolidine - Azacycle - Organoheterocyclic compound - Secondary aliphatic amine - Ether - Secondary amine - Organohalogen compound - Amine - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen 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