Structure Information
Structure

Compound Identification

SMILES

CCCCN(CC)C(=O)C1=CC=C(C[S@](=O)C2=CC=C(Br)C=C2)O1

InChIKey

InChIKey=SHGSUPUMTPSFQI-DEOSSOPVSA-N

Formula

C18H22BrNO3S

Mass

412.34

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenyl sulfoxides

Intermediate Tree Nodes

Not available

Direct Parent

Phenyl sulfoxides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenyl sulfoxide - 2-heteroaryl carboxamide - Furoic acid or derivatives - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Furan - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Sulfoxide - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Sulfinyl compound - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenyl sulfoxides. These are organosulfur compounds containing a sulfoxide group substituted with a phenyl group.

External Descriptors

Not available

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