Structure Information
Structure

Compound Identification

SMILES

CC(C)C[C@@H](CSC1=CC=C(Br)C=C1)N1CCN(CC(C)C)CCC1=O

InChIKey

InChIKey=FKMYFACHUJITIR-IBGZPJMESA-N

Formula

C21H33BrN2OS

Mass

441.47

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organosulfur compounds

Class

Thioethers

Subclass

Aryl thioethers

Intermediate Tree Nodes

Not available

Direct Parent

Aryl thioethers

Alternative Parents

Thiophenol ethers Bromobenzenes Alkylarylthioethers 1,4-diazepanes Aryl bromides Tertiary carboxylic acid amides Trialkylamines Lactams Amino acids and derivatives Sulfenyl compounds Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Thiophenol ether - Aryl thioether - Diazepane - Halobenzene - Bromobenzene - 1,4-diazepane - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Tertiary carboxylic acid amide - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Lactam - Amino acid or derivatives - Sulfenyl compound - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organohalogen compound - Organobromide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.

External Descriptors

Not available

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