Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(CCSC)NC(=O)C1=C(SC)N=CC=C1

InChIKey

InChIKey=GSUDSBHFXNANTM-UHFFFAOYSA-N

Formula

C13H18N2O3S2

Mass

314.42

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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

Methionine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Methionine or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Nicotinamide - Pyridine carboxylic acid or derivatives - Aryl thioether - Fatty acid ester - Alkylarylthioether - Pyridine - Fatty acyl - Vinylogous thioester - Methyl ester - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Azacycle - Dialkylthioether - Sulfenyl compound - Thioether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as methionine and derivatives. These are compounds containing methionine or a derivative thereof resulting from reaction of methionine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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