Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC(=CC(NC(=O)NCCSCC2=CC=CC=C2)=C1)C(=O)OC

InChIKey

InChIKey=YGURMGOTZRMKBR-UHFFFAOYSA-N

Formula

C20H22N2O5S

Mass

402.47

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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

Phthalic acid and derivatives - Phthalate esters

Direct Parent

m-Phthalate esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Meta-phthalic acid ester - Meta_phthalic_acid - Benzoate ester - N-phenylurea - Benzoyl - Methyl ester - Carboxylic acid ester - Urea - Carboxylic acid derivative - Dialkylthioether - Thioether - Sulfenyl compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as m-phthalate esters. These are ester derivatives of m-phthalic acids, which are based on a benzene 1,3-dicarboxylic acid skeleton.

External Descriptors

Not available

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