Structure Information
Structure

Compound Identification

SMILES

CCCCCCC1=C(Br)C2=C(SC(=N2)C(CC(S)=O)C(O)=O)C=C1

InChIKey

InChIKey=IGXKFGRDEGETKW-UHFFFAOYSA-N

Formula

C17H20BrNO3S2

Mass

430.38

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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

1,3-benzothiazole - Thia fatty acid - Aryl bromide - Aryl halide - Fatty acyl - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Carbothioic s-acid - Carbodithioic acid - Alkylthiol - Carboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Thiocarboxylic acid or derivatives - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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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