Compound Identification
SMILES
CCN1C(SC2=CC=CC=C12)=CC1=[N+](CCO)C2=C(S1)C=C(C)C=C2
InChIKey
InChIKey=LQDFHUCUOSXGKT-UHFFFAOYSA-N
Formula
C20H21N2OS2
Mass
369.52
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 Heteroaromatic compounds Ketene acetals Azacyclic compounds Alkanolamines Primary alcohols Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Ketene acetal or derivatives - Alkanolamine - Azacycle - Organonitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Amine - Organooxygen compound - Primary alcohol - 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
Not available