Compound Identification
SMILES
COC1=CC2=C(SC(=CC=CC3=[N+](CCOCCCS([O-])(=O)=O)C4=C(S3)C=CC(OC)=C4)N2CCOCCCS([O-])(=O)=O)C=C1
InChIKey
InChIKey=SOJUNKASYRXAPR-UHFFFAOYSA-M
Formula
C29H35N2O10S4
Mass
699.84
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 Thiazoles Sulfonyls Organosulfonic acids Alkanesulfonic acids Heteroaromatic compounds Ketene acetals Dialkyl ethers Azacyclic compounds Organic salts Hydrocarbon derivatives Amines Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Azole - Heteroaromatic compound - Alkanesulfonic acid - Thiazole - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ketene acetal or derivatives - Azacycle - Dialkyl ether - Ether - Organic salt - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - 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