Compound Identification
SMILES
FC(F)(F)CC(=O)C(C#N)=C1NC2=CC=CC=C2S1
InChIKey
InChIKey=CPWZFWJZBXLOMC-UHFFFAOYSA-N
Formula
C12H7F3N2OS
Mass
284.26
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 Benzenoids Vinylogous amides Thiazoles Acryloyl compounds Enones Ketones Ketene acetals Azacyclic compounds Nitriles Organofluorides Organic oxides Amines Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Benzenoid - Vinylogous thioester - Enone - Vinylogous amide - Acryloyl-group - Thiazole - Ketene acetal or derivatives - Ketone - Azacycle - Carbonitrile - Nitrile - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Carbonyl group - Cyanide - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Hydrocarbon derivative - 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