Compound Identification
SMILES
CC1=CC=C(SCC2=NN(C(=O)\C2=C\NCC2=CN=CC=C2)C2=NC3=CC=CC=C3S2)C=C1
InChIKey
InChIKey=KPMNJTZSYLOBHI-HMMYKYKNSA-N
Formula
C25H21N5OS2
Mass
471.6
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
Thiophenol ethers Toluenes Alkylarylthioethers Aralkylamines Pyridines and derivatives Pyrazolones Vinylogous amides Thiazoles Heteroaromatic compounds Sulfenyl compounds Allylamines Enamines Dialkylamines Carboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Aryl thioether - Thiophenol ether - Aralkylamine - Alkylarylthioether - Toluene - Monocyclic benzene moiety - Pyrazolinone - Pyridine - Benzenoid - Azole - Pyrazoline - Heteroaromatic compound - Vinylogous amide - Thiazole - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Allylamine - Azacycle - Sulfenyl compound - Thioether - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Amine - 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