Compound Identification
SMILES
O=C(NC1C[C@@H]2CC[C@H](C1)N2C1=NC=CC=N1)N1CSC[C@@H]1C#N
InChIKey
InChIKey=GQXIMXPJCULSCX-GSPSYOTPSA-N
Formula
C16H20N6OS
Mass
344.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Tropane alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Tropane alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tropane alkaloids
Alternative Parents
Dialkylarylamines Aminopyrimidines and derivatives Piperidines Thiazolidines Pyrrolidines Heteroaromatic compounds Ureas Thiohemiaminal derivatives Nitriles Dialkylthioethers Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tropane alkaloid - Dialkylarylamine - Aminopyrimidine - Piperidine - Pyrimidine - Pyrrolidine - Thiazolidine - Heteroaromatic compound - Urea - Carbonitrile - Nitrile - Thioether - Hemithioaminal - Azacycle - Organoheterocyclic compound - Dialkylthioether - Cyanide - Organic oxygen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Amine - Organic nitrogen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tropane alkaloids. These are organic compounds containing the nitrogenous bicyclic alkaloid parent N-Methyl-8-azabicyclo[3.2.1]octane.
External Descriptors
Not available