Compound Identification
SMILES
COC1=C(C)C=C(C=C1)C1=NSC2=C1C=C(C=C2)N1C(=O)C=C(N(C)C1=O)C(F)(F)F
InChIKey
InChIKey=VTZCNZXSRMHVAN-UHFFFAOYSA-N
Formula
C21H16F3N3O3S
Mass
447.43
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
Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Toluenes Pyrimidones Hydropyrimidines Vinylogous amides Heteroaromatic compounds Thiazoles Lactams Ureas Azacyclic compounds Hydrocarbon derivatives Alkyl fluorides Organonitrogen compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,2-benzothiazole - Anisole - Phenol ether - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Pyrimidone - Toluene - Monocyclic benzene moiety - Hydropyrimidine - Pyrimidine - Benzenoid - Thiazole - Vinylogous amide - Azole - Heteroaromatic compound - Urea - Lactam - Azacycle - Ether - Organic oxide - Organohalogen compound - Organic oxygen compound - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Alkyl halide - Alkyl fluoride - 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