Compound Identification
SMILES
CCCC#CCCSC1=NC2=C(S1)C=C(NC(=O)C1=NC=C(C=C1)C(=O)OC)C=C2
InChIKey
InChIKey=HXQODQFHTBPDQF-UHFFFAOYSA-N
Formula
C22H21N3O3S2
Mass
439.55
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
Pyridinecarboxylic acids 2-heteroaryl carboxamides Alkylarylthioethers Benzenoids Thiazoles Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Aryl thioether - Alkylarylthioether - Benzenoid - Pyridine - Azole - Heteroaromatic compound - Methyl ester - Thiazole - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Thioether - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - 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