Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC(=CC(NC(=O)CSC2=NN=C(O2)C2=CC(OC)=CC=C2)=C1)C(=O)OC

InChIKey

InChIKey=VWZIOZGEBXQOEL-UHFFFAOYSA-N

Formula

C21H19N3O7S

Mass

457.46

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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

Meta-phthalic acid ester - Phthalate ester - Acylaminobenzoic acid or derivatives - Meta_phthalic_acid - Benzoate ester - Anilide - Phenol ether - N-arylamide - Phenoxy compound - Aryl thioether - Methoxybenzene - Benzoyl - Anisole - Alkylarylthioether - Alkyl aryl ether - Dicarboxylic acid or derivatives - 1,3,4-oxadiazole - Oxadiazole - Heteroaromatic compound - Methyl ester - Azole - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Sulfenyl compound - Ether - Thioether - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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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