Structure Information
Structure

Compound Identification

SMILES

COC(=O)CN1C(SC2=C1C=CC(Br)=C2)=NC(=O)C1=CC(OC)=C(OC)C=C1

InChIKey

InChIKey=XEBFMLFYXFCPAT-UHFFFAOYSA-N

Formula

C19H17BrN2O5S

Mass

465.32

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Alpha amino acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid ester - Dimethoxybenzene - O-dimethoxybenzene - Benzoic acid or derivatives - 1,3-benzothiazole - Anisole - Methoxybenzene - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Methyl ester - Thiazole - Isothiourea - Carboxylic acid ester - Monocarboxylic acid or derivatives - Ether - Organoheterocyclic compound - Azacycle - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.

External Descriptors

Not available

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