Compound Identification
SMILES
CCN1C(SC2=CC=CC=C12)=CC(=O)C1=CC=CC(=C1)C1=NC(=NC(=N1)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl
InChIKey
InChIKey=ZPOVTDORSQZBIY-UHFFFAOYSA-N
Formula
C22H14Cl6N4OS
Mass
595.14
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 ketones Aryl thioethers Benzoyl derivatives Vinylogous thioesters 1,3,5-triazines Vinylogous amides Acryloyl compounds Thiazoles Enones Heteroaromatic compounds Ketene acetals Azacyclic compounds Organochlorides Organic oxides Amines Alkyl chlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Benzoyl - Aryl ketone - Monocyclic benzene moiety - Triazine - Benzenoid - Vinylogous thioester - 1,3,5-triazine - Vinylogous amide - Heteroaromatic compound - Acryloyl-group - Enone - Thiazole - Ketone - Ketene acetal or derivatives - Azacycle - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen compound - Alkyl chloride - Alkyl halide - 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