Compound Identification
SMILES
CC\C(NCC1=CC=CC=C1)=C1/C(=O)N(N=C1C(F)(F)F)C1=NC2=CC=CC=C2S1
InChIKey
InChIKey=CEGGOUGATWDISX-SAPNQHFASA-N
Formula
C21H17F3N4OS
Mass
430.45
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
Benzylamines Phenylmethylamines Aralkylamines Pyrazolones Vinylogous amides Thiazoles Heteroaromatic compounds Azacyclic compounds Enamines Dialkylamines Carboxylic acids and derivatives Carbonyl compounds Alkyl fluorides Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Benzylamine - Phenylmethylamine - Aralkylamine - Monocyclic benzene moiety - Pyrazolinone - Benzenoid - Azole - Pyrazoline - Heteroaromatic compound - Thiazole - Vinylogous amide - Azacycle - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Amine - 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