Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC(=O)C2=CC=CO2)C(Br)=CC(C=C2C(=N)N3C=CSC3=NC2=O)=C1

InChIKey

InChIKey=DQGPGSSOWNFRIB-UHFFFAOYSA-N

Formula

C19H12BrN3O5S

Mass

474.29

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol esters

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenol esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenol ester - Furoic acid ester - Anisole - Phenol ether - Methoxybenzene - Phenoxy compound - Furoic acid or derivatives - Halobenzene - Pyrimidone - Bromobenzene - Alkyl aryl ether - 1,4,5,6-tetrahydropyrimidine - Hydropyrimidine - Pyrimidine - Aryl bromide - Aryl halide - Imidolactam - Monocyclic benzene moiety - Furan - Heteroaromatic compound - Meta-thiazoline - N-acylimine - Carboxylic acid ester - Isothiourea - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid amidine - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Ether - Carboximidamide - Amidine - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organobromide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.

External Descriptors

Not available

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