Compound Identification
SMILES
CC1=CC=C(C=C1)S([O-])(=O)=O.CC[N+]1=C(C)SC2=C1C=C(OC)C=C2
InChIKey
InChIKey=RAPZVIBWDBUCCW-UHFFFAOYSA-M
Formula
C18H21NO4S2
Mass
379.49
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
Anisoles Alkyl aryl ethers Thiazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic salts Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
1,3-benzothiazole - Anisole - Alkyl aryl ether - Benzenoid - Azole - Thiazole - Heteroaromatic compound - Ether - Azacycle - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Organic salt - 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