Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=C(SC2=CC=C(Br)C=C2)C=CC(=C1)C(=O)NCC1=CC(Cl)=C(Cl)C=C1

InChIKey

InChIKey=XAAMLRCWCULUQL-UHFFFAOYSA-N

Formula

C20H13BrCl2N2O3S

Mass

512.2

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Benzamides

Direct Parent

N-benzylbenzamides

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

N-benzylbenzamide - Diarylthioether - P-sulfanylbenzoic acid or derivatives - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Benzoyl - 1,2-dichlorobenzene - Thiophenol ether - Bromobenzene - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - C-nitro compound - Carboxamide group - Secondary carboxylic acid amide - Organic nitro compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Thioether - Organic oxoazanium - Hydrocarbon derivative - Organic oxide - Organic zwitterion - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-benzylbenzamides. These are compounds containing a benzamide moiety that is N-linked to a benzyl group.

External Descriptors

Not available

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