Compound Identification
SMILES
CCN1C(=S)SC(=CC=CC=C2SC3=CC=CC=C3N2CCCS(O)(=O)=O)C1=O
InChIKey
InChIKey=JLOOCJQAEWGRMY-UHFFFAOYSA-N
Formula
C19H20N2O4S4
Mass
468.62
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 Thiazolidinethiones Benzenoids Thiazoles Sulfonyls Organosulfonic acids Cyclic dithiocarbamic acid esters Alkanesulfonic acids Ketene acetals Carboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Benzenoid - Thiazolidinethione - Cyclic dithiocarbamic acid ester - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Dithiocarbamic acid ester - Alkanesulfonic acid - Thiazolidine - Thiazole - Sulfonyl - Organosulfonic acid - Ketene acetal or derivatives - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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