Compound Identification
SMILES
CN1\C(SC2=CC=CC=C12)=C\C1=[N+](CC2CCCO2)C(=O)\C(S1)=C1\SC2=C(C=C(Cl)C=C2)N1C
InChIKey
InChIKey=MZUUQPPCKIFTHG-BZZOAKBMSA-N
Formula
C25H23ClN3O2S3
Mass
529.11
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 Vinylogous thioesters Aryl chlorides Benzenoids Vinylogous amides Thiazolines Thiazoles Oxolanes Ketene acetals N-acylimines Dialkyl ethers Carboxylic acids and derivatives Azacyclic compounds Oxacyclic compounds Amines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Aryl chloride - Aryl halide - Benzenoid - Vinylogous thioester - Oxolane - Thiazole - Meta-thiazoline - Vinylogous amide - Ketene acetal or derivatives - N-acylimine - Dialkyl ether - Ether - Oxacycle - Azacycle - Carboxylic acid derivative - Amine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen 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