Compound Identification
SMILES
OC(=O)CCC(=CC1=C(F)C(F)=C(F)C(F)=C1F)C1=NC2=CC=CC=C2S1
InChIKey
InChIKey=DJOQIVHEWLGXCZ-UHFFFAOYSA-N
Formula
C18H10F5NO2S
Mass
399.34
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
Medium-chain fatty acids Fluorobenzenes Heterocyclic fatty acids Halogenated fatty acids Unsaturated fatty acids Aryl fluorides Thiazoles Heteroaromatic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Carbonyl compounds Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Medium-chain fatty acid - Fluorobenzene - Halobenzene - Halogenated fatty acid - Heterocyclic fatty acid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Fatty acid - Benzenoid - Unsaturated fatty acid - Azole - Heteroaromatic compound - Thiazole - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - 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