Compound Identification
SMILES
ClC1=CC=CC(=C1)C#CCSC1=NSN=C1C1CN2CCC1CC2
InChIKey
InChIKey=PVNVNLKZGZSLBW-UHFFFAOYSA-N
Formula
C18H18ClN3S2
Mass
375.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Quinuclidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinuclidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Quinuclidines
Alternative Parents
Chlorobenzenes Aralkylamines Alkylarylthioethers Piperidines Aryl chlorides Thiadiazoles Heteroaromatic compounds Trialkylamines Sulfenyl compounds Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinuclidine - Aryl thioether - Chlorobenzene - Halobenzene - Alkylarylthioether - Aralkylamine - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Piperidine - Heteroaromatic compound - Azole - Thiadiazole - Tertiary aliphatic amine - Tertiary amine - Thioether - Sulfenyl compound - Azacycle - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinuclidines. These are compounds containing a 1-azabicyclo[2.2.2]octane moiety.
External Descriptors
Not available