Compound Identification
SMILES
FC1=CC2=C(C=C1)N(CC#C)C(S2)=NC(=O)CS(=O)(=O)CC(=O)N1CCC2=CC=CC=C12
InChIKey
InChIKey=FDNIRTJUFVXBQJ-UHFFFAOYSA-N
Formula
C22H18FN3O4S2
Mass
471.52
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
Indoles and derivatives Aryl fluorides Benzenoids Thiazoles Tertiary carboxylic acid amides Sulfones Heteroaromatic compounds N-acylimines Isothioureas Acetylides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Indole or derivatives - Aryl fluoride - Aryl halide - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Tertiary carboxylic acid amide - Sulfonyl - Sulfone - Carboxamide group - Isothiourea - N-acylimine - Acetylide - Carboxylic acid derivative - Azacycle - Organofluoride - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Carbonyl group - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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