Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzothiazoles

Alternative Parents

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

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