Compound Identification
SMILES
OC(CCl)(C1=NC2=C(S1)C=C(C=C2)C#N)C1=C(F)C=C(F)C=C1
InChIKey
InChIKey=RAYJROQQSNQGCU-UHFFFAOYSA-N
Formula
C16H9ClF2N2OS
Mass
350.77
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
Fluorobenzenes Aryl fluorides Thiazoles Tertiary alcohols Heteroaromatic compounds Chlorohydrins Nitriles Azacyclic compounds Organofluorides Organochlorides Hydrocarbon derivatives Aromatic alcohols Alkyl chlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Tertiary alcohol - Chlorohydrin - Halohydrin - Azacycle - Carbonitrile - Nitrile - Alcohol - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Hydrocarbon derivative - Cyanide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl chloride - 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