Structure Information
Structure

Compound Identification

SMILES

[Na+].CC1=CC2=C(NC(S2)(C2=CC=C(N)C=C2)S([O-])(=O)=O)C=C1

InChIKey

InChIKey=FTZKCHJUCUBJDH-UHFFFAOYSA-M

Formula

C14H13N2NaO3S2

Mass

344.38

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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 - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Alkylarylthioether - Monocyclic benzene moiety - Primary aromatic amine - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Thiazole - Azacycle - Organic alkali metal salt - Thioether - Organic sodium salt - Amine - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - 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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