Compound Identification
SMILES
CCN1C(SC2=C1C=CC(Br)=C2)=NC(=O)CS(=O)(=O)CC(=O)N1CCCC1
InChIKey
InChIKey=PSVZRSKBTCGCGT-UHFFFAOYSA-N
Formula
C17H20BrN3O4S2
Mass
474.39
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
N-acylpyrrolidines Benzenoids Aryl bromides Thiazoles Tertiary carboxylic acid amides Sulfones Heteroaromatic compounds N-acylimines Isothioureas Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - N-acylpyrrolidine - Aryl bromide - Aryl halide - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Tertiary carboxylic acid amide - Sulfonyl - Sulfone - Pyrrolidine - Carboxamide group - N-acylimine - Isothiourea - Azacycle - Carboxylic acid derivative - Organohalogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organobromide - Organonitrogen 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