Structure Information
Structure

Compound Identification

SMILES

O=C(OC1=CC=C(CC2SC(=O)NC2=O)C=C1)C1COC(=N1)C1=NC=CN=C1

InChIKey

InChIKey=MUQXGPZKRMVAEQ-UHFFFAOYSA-N

Formula

C18H14N4O5S

Mass

398.39

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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 heteromonocyclic compounds

Substituents

Alpha-amino acid ester - Phenol ester - Phenoxy compound - Thiazolidinedione - Monocyclic benzene moiety - Pyrazine - Benzenoid - Dicarboximide - Oxazoline - Heteroaromatic compound - Thiazolidine - Carboxylic acid ester - Thiocarbamic acid derivative - Organoheterocyclic compound - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Aromatic heteromonocyclic 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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