Structure Information
Structure

Compound Identification

SMILES

[Na+].[O-]S(=O)(=O)CCCCN1C(SC2=CC=CC=C12)=CC=C1N(N=CC2=CC=CC=C2)C(OC1=O)=CC=CC1=[N+](CCCCS([O-])(=O)=O)C2=CC=CC=C2S1

InChIKey

InChIKey=HOMCEDOJLDWBKC-UHFFFAOYSA-M

Formula

C37H35N4NaO8S4

Mass

814.94

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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 - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Oxazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Thiazole - Ketene acetal or derivatives - Lactone - Tertiary amine - Organic alkali metal salt - Azacycle - Oxacycle - Organic sodium salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic salt - Organic zwitterion - 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

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