Structure Information
Structure

Compound Identification

SMILES

CCC1=CC=C(N\C(C)=C2\C(=O)N(N=C2C(F)(F)F)C2=NC3=CC=CC=C3S2)C=C1

InChIKey

InChIKey=NBHFOUJVZWLSCB-SFQUDFHCSA-N

Formula

C21H17F3N4OS

Mass

430.45

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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 - Monocyclic benzene moiety - Benzenoid - Pyrazolinone - Azole - Heteroaromatic compound - Vinylogous amide - Thiazole - Pyrazoline - Azacycle - Carboxylic acid derivative - Enamine - Organic oxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organooxygen compound - Alkyl fluoride - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Alkyl halide - 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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