Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC=C(NC(=O)CC2N(CCC3=CC=CC=C3)C(=S)N(C2=O)C2=CC=C(OC)C=C2)C=C1

InChIKey

InChIKey=XLHCMRPRTSCVHR-UHFFFAOYSA-N

Formula

C28H27N3O5S

Mass

517.6

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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

Not available

Direct Parent

Acylaminobenzoic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Acylaminobenzoic acid or derivatives - Phenylimidazolidine - Alpha-amino acid or derivatives - Benzoate ester - N-phenylthiourea - Anilide - Methoxyaniline - Anisole - Phenoxy compound - Benzoyl - Phenol ether - N-arylamide - Methoxybenzene - Alkyl aryl ether - Imidazolidinone - Methyl ester - Imidazolidine - Thiourea - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic oxide - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.

External Descriptors

Not available

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