Compound Identification
SMILES
CC\C(=C/C1=[N+](CC)C2=CC=CC=C2S1)\C=C1/SC2=C(C=C(OC)C=C2)N1CC(O)CS([O-])(=O)=O
InChIKey
InChIKey=DICLHPYFAJCAKT-UHFFFAOYSA-N
Formula
C25H28N2O5S3
Mass
532.69
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 Aryl thioethers Alkyl aryl ethers Alkanesulfonic acids Thiazoles Sulfonyls Heteroaromatic compounds Organosulfonic acids Ketene acetals Secondary alcohols Azacyclic compounds Hydrocarbon derivatives Amines Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Azole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Thiazole - Alkanesulfonic acid - Secondary alcohol - Ketene acetal or derivatives - Azacycle - Ether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organic oxygen compound - Alcohol - Organic oxide - Hydrocarbon derivative - Organic zwitterion - 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