Structure Information
Structure

Compound Identification

SMILES

CC(CS)C(=O)N1CC(CC1C(O)=O)OC1=CC=C(C=C1)C1NC(=O)C2=CC(=C(Cl)C=C2N1)S(N)(=O)=O

InChIKey

InChIKey=QTTPYECWSCVAOK-UHFFFAOYSA-N

Formula

C23H25ClN4O7S2

Mass

569.04

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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 - N-acyl-alpha amino acids and derivatives

Direct Parent

N-acyl-alpha amino acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Proline or derivatives - N-acyl-alpha-amino acid - Quinazoline - Phenoxy compound - N-acylpyrrolidine - Phenol ether - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Alkyl aryl ether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid amide - Vinylogous amide - Aminosulfonyl compound - Tertiary carboxylic acid amide - Pyrrolidine - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Lactam - Alkylthiol - Carboxylic acid - Ether - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Amine - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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