Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(NC(=O)CSCC(=O)N=C2SC3=C(C=CC(Br)=C3)N2CC#C)SC2=C1CCCC2

InChIKey

InChIKey=HFGLKGPPIHKCAT-UHFFFAOYSA-N

Formula

C24H22BrN3O4S3

Mass

592.54

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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 - Thiophene carboxylic acid or derivatives - N-arylamide - Aryl bromide - Aryl halide - Benzenoid - Azole - Thiazole - Heteroaromatic compound - Thiophene - Vinylogous amide - Methyl ester - Carboxamide group - Carboxylic acid ester - Isothiourea - Secondary carboxylic acid amide - N-acylimine - Thioether - Dialkylthioether - Sulfenyl compound - Acetylide - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxide - Organohalogen compound - Organobromide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Organopnictogen 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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