Compound Identification
SMILES
CN1C(SC2=CC=CC=C12)=C1C(=O)N(N=C1NC(=O)C(F)(F)F)C1=CC=CC=C1
InChIKey
InChIKey=KWJMLHXOVFWZIY-UHFFFAOYSA-N
Formula
C19H13F3N4O2S
Mass
418.39
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 Pyrazolones Benzene and substituted derivatives Vinylogous amides Thiazoles Ketene acetals Amidrazones Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Monocyclic benzene moiety - Pyrazolinone - Benzenoid - Vinylogous thioester - Thiazole - Pyrazoline - Vinylogous amide - Carboxylic acid amidrazone - Ketene acetal or derivatives - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl fluoride - Organooxygen compound - Amine - 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