Compound Identification
SMILES
FC1=CC2=C(N=C(NC(=O)C3=C(Cl)N=CC=C3)S2)C(F)=C1F
InChIKey
InChIKey=NKXPKQNYPMDGKM-UHFFFAOYSA-N
Formula
C13H5ClF3N3OS
Mass
343.71
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
Nicotinamides 2-halopyridines Aryl chlorides Aryl fluorides Benzenoids Vinylogous halides Thiazoles Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Organonitrogen compounds Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Pyridine carboxylic acid or derivatives - Pyridinecarboxamide - Nicotinamide - 2-halopyridine - Aryl chloride - Aryl fluoride - Aryl halide - Benzenoid - Pyridine - Azole - Heteroaromatic compound - Vinylogous halide - Thiazole - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Organohalogen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - Organofluoride - 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