Compound Identification
SMILES
CCN1C(SC2=C1C=C(Cl)C=C2)=CC(CC)=CC1=[N+](CCCCS(O)(=O)=O)C2=C([Se]1)C=CC(OC)=C2
InChIKey
InChIKey=KMOKYVDJZCIOCI-UHFFFAOYSA-O
Formula
C26H30ClN2O4S2Se
Mass
613.08
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
Anisoles Aryl thioethers Alkyl aryl ethers Aryl chlorides Thiazoles Sulfonyls Selenazoles Organosulfonic acids Alkanesulfonic acids Heteroaromatic compounds Ketene acetals Azacyclic compounds Organoselenium compounds Organic oxides Amines Organochlorides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Anisole - Phenol ether - Alkyl aryl ether - Aryl chloride - Aryl halide - Benzenoid - Azole - Heteroaromatic compound - Alkanesulfonic acid - 1,3-selenazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Thiazole - Ketene acetal or derivatives - Ether - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organoselenium compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic cation - 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