Compound Identification
SMILES
CCOC(=O)C(C(C(C(C)=O)C(=O)OCC)C1=CC2=C(C=C1)[N+](CC)=C(S2)C=C1SC2=CC=CC=C2N1CC)C(C)=O
InChIKey
InChIKey=ITOQWDRSROUIQE-UHFFFAOYSA-N
Formula
C32H37N2O6S2
Mass
609.78
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 Beta-keto acids and derivatives Fatty acid esters 1,3-dicarbonyl compounds Benzenoids Dicarboxylic acids and derivatives Heteroaromatic compounds Thiazoles Carboxylic acid esters Ketene acetals Ketones Azacyclic compounds Organic oxides Amines Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Beta-keto acid - Fatty acid ester - Fatty acyl - Benzenoid - Dicarboxylic acid or derivatives - 1,3-dicarbonyl compound - Keto acid - Azole - Heteroaromatic compound - Thiazole - Carboxylic acid ester - Ketene acetal or derivatives - Ketone - Carboxylic acid derivative - Azacycle - Organooxygen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen 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
Not available