Structure Information
Structure

Compound Identification

SMILES

CC1C(=O)[N+](C)(SC2=CC=CC=C12)C1=C(OCCCCBr)C=CC(Cl)=C1

InChIKey

InChIKey=RBXXPRSQFGYSMY-UHFFFAOYSA-N

Formula

C20H22BrClNO2S

Mass

455.81

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiazines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzothiazines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzothiazine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Ortho-thiazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azacycle - Carboxylic acid derivative - Ether - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organobromide - Carbonyl group - Organic oxygen compound - Alkyl halide - Alkyl bromide - Organic nitrogen compound - Organonitrogen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzothiazines. These are organic compounds containing a benzene fused to a thiazine ring (a six-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).

External Descriptors

Not available

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