Compound Identification
SMILES
CCC(=O)N=C1SC2=C(C=CC(=C2)S(C)(=O)=O)N1CC#C
InChIKey
InChIKey=YJTGHAQIKWCFJX-UHFFFAOYSA-N
Formula
C14H14N2O3S2
Mass
322.4
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
Benzenoids Thiazoles Sulfones Heteroaromatic compounds N-acylimines Isothioureas Carboxylic acids and derivatives Azacyclic compounds Acetylides Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Benzenoid - Azole - Sulfone - Sulfonyl - Thiazole - Heteroaromatic compound - Isothiourea - N-acylimine - Acetylide - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - 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