Compound Identification
SMILES
BrC1=CC2=C(C=C1)N(CC=C)C(S2)=NC(=O)CS(=O)(=O)CC(=O)N1CCC2=CC=CC=C12
InChIKey
InChIKey=SGDRCPJGYDBBGL-UHFFFAOYSA-N
Formula
C22H20BrN3O4S2
Mass
534.44
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
Indoles and derivatives 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 - Indole or derivatives - Aryl bromide - Aryl halide - Benzenoid - Azole - Heteroaromatic compound - Sulfone - Thiazole - Tertiary carboxylic acid amide - Sulfonyl - Carboxamide group - Isothiourea - N-acylimine - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen 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