Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)OC(=O)C1=NOC(CNC(=O)CC2=NN=C(CC3=NC4=C(S3)C=CC(Cl)=C4)O2)=C1

InChIKey

InChIKey=WSAYOPPGCLTQNZ-UHFFFAOYSA-N

Formula

C21H20ClN5O5S

Mass

489.93

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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 - Aryl chloride - Aryl halide - Benzenoid - 1,3,4-oxadiazole - Azole - Heteroaromatic compound - Thiazole - Oxadiazole - Isoxazole - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Oxacycle - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen 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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