Structure Information
Structure

Compound Identification

SMILES

CC1=C(NC2=CC=C(Br)C=C2)C(=O)N(N=C1C(F)(F)F)C1=NC2=CC=CC=C2S1

InChIKey

InChIKey=UYQJXPOTLHQCOB-UHFFFAOYSA-N

Formula

C19H12BrF3N4OS

Mass

481.29

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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 - Aniline or substituted anilines - Aminopyridazine - Bromobenzene - Halobenzene - Pyridazinone - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Primary aromatic amine - Pyridazine - Azole - Heteroaromatic compound - Thiazole - Lactam - Azacycle - Secondary amine - Organofluoride - Organobromide - Organohalogen compound - Amine - Alkyl halide - Hydrocarbon derivative - Alkyl fluoride - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen 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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