Compound Identification
SMILES
CCN(CC)N(C(C)=O)C1=NC2=C(S1)C(=C1SC(=NC1=C2Cl)N(N(CC)CC)C(C)=O)C(F)(F)F
InChIKey
InChIKey=YXNJDQKDBJCXIJ-UHFFFAOYSA-N
Formula
C21H26ClF3N6O2S2
Mass
551.04
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
Benzenoids Aryl chlorides Thiazoles Heteroaromatic compounds Acetamides Carboxylic acid hydrazides Azacyclic compounds Organonitrogen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Aryl chloride - Aryl halide - Benzenoid - Azole - Heteroaromatic compound - Acetamide - Thiazole - Carboxylic acid hydrazide - Carboxylic acid derivative - Azacycle - Organofluoride - Organochloride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen 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