Compound Identification
SMILES
OC12CC3CC(C1)CC(C3)(C2)C(=O)NC1=CC2=C(C=C1)N=C(SCC(F)F)S2
InChIKey
InChIKey=HKMLJABDKILULD-UHFFFAOYSA-N
Formula
C20H22F2N2O2S2
Mass
424.52
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
N-arylamides Alkylarylthioethers Benzenoids Thiazoles Tertiary alcohols Heteroaromatic compounds Secondary carboxylic acid amides Cyclic alcohols and derivatives Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Carbonyl compounds Alkyl fluorides Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Aryl thioether - N-arylamide - Alkylarylthioether - Benzenoid - Azole - Cyclic alcohol - Tertiary alcohol - Thiazole - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Thioether - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organopnictogen compound - Alkyl fluoride - Alcohol - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - 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