Compound Identification
SMILES
OC(=O)C(F)(F)F.CCN(CC)CCN(CCNCCC1=C2SC(=O)NC2=C(O)C=C1)C(=O)CCOCCC1=CC(Cl)=CC=C1
InChIKey
InChIKey=RQEZOUFKOZPJHK-UHFFFAOYSA-N
Formula
C30H40ClF3N4O6S
Mass
677.18
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
Phenethylamines 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Chlorobenzenes Aryl chlorides Thiazoles Tertiary carboxylic acid amides Alpha-halocarboxylic acids Heteroaromatic compounds Trialkylamines Amino acids and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Dialkylamines Dialkyl ethers Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organochlorides Organic oxides Organofluorides
Molecular Framework
Not available
Substituents
1,3-benzothiazole - Phenethylamine - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Halobenzene - Aralkylamine - Phenol - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Azole - Heteroaromatic compound - Thiazole - Tertiary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxamide group - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Secondary aliphatic amine - Ether - Azacycle - Monocarboxylic acid or derivatives - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Alkyl fluoride - Organic oxygen compound - Organofluoride - Organonitrogen compound - Alkyl halide - Amine - Organochloride - Organooxygen compound - Organic nitrogen 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