Structure Information
Structure

Compound Identification

SMILES

OC(=O)CCC1=C(N\C(S1)=C/C1=NC(=O)CS1)C1=C(Br)C=CS1

InChIKey

InChIKey=AZBAQHIWXAHEFA-VZUCSPMQSA-N

Formula

C14H11BrN2O3S3

Mass

431.34

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acids and conjugates

Intermediate Tree Nodes

Not available

Direct Parent

Thia fatty acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Thia fatty acid - Aryl bromide - Aryl halide - Heteroaromatic compound - Meta-thiazoline - Thiophene - Ketene acetal or derivatives - Thioenolether - N-acylimine - Carboxylic acid derivative - Carboxylic acid - Enamine - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organohalogen compound - Organic oxygen compound - Organic oxide - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Amine - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as thia fatty acids. These are fatty acid derivatives obtained by insertion of a sulfur atom at specific positions in the chain.

External Descriptors

Not available

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