Structure Information
Structure

Compound Identification

SMILES

CC(C)N(C(C)C)S(=O)(=O)C1=CC2=C(C=C1)N=C(NC(=O)C1=CC(Br)=CN=C1)S2

InChIKey

InChIKey=UBLNRRINAMLGDA-UHFFFAOYSA-N

Formula

C19H21BrN4O3S2

Mass

497.43

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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 - Nicotinamide - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - Aryl bromide - Aryl halide - Pyridine - Organosulfonic acid amide - Benzenoid - Sulfonyl - Azole - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Aminosulfonyl compound - Thiazole - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organobromide - Organohalogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - 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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