Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)CN1C(SC2=C1C=CC(Cl)=C2)=NC(=O)C1=CC=C(C=C1)N(CC)CC

InChIKey

InChIKey=OTCDJWOQPDMLBR-UHFFFAOYSA-N

Formula

C22H24ClN3O3S

Mass

445.96

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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 - Aminobenzoic acid or derivatives - Benzoic acid or derivatives - 1,3-benzothiazole - Benzoyl - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Thiazole - Azole - Tertiary amine - Carboxylic acid ester - Isothiourea - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Amine - Organic oxygen compound - Organohalogen compound - Organochloride - 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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