Compound Identification
SMILES
CCN1C(SC2=CC=CC=C12)=CC=CC=C1C=CC(C=C1)=[N+](C)C
InChIKey
InChIKey=NRPYYACQUPIKLE-UHFFFAOYSA-N
Formula
C21H23N2S
Mass
335.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiazoles
Alternative Parents
Aryl thioethers Benzenoids Thiazoles Secondary ketimines Azomethines Ketene acetals Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Benzenoid - Azomethine - Secondary ketimine - Thiazole - Ketene acetal or derivatives - Azacycle - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors
CHEBI:52864 : tertiary amine - benzothiazolium ion