Structure Information
Structure

Compound Identification

SMILES

CN(C1=CC2=C(OC(=CC2=O)C(=O)N[C@@H](CC2=CC=C(Cl)C=C2)C(=O)N2CCN(CC2)C2=CC=CC=C2CN2CCCC2=O)C=C1)S(C)(=O)=O

InChIKey

InChIKey=UYRAPLIGCYJMLO-LJAQVGFWSA-N

Formula

C36H38ClN5O7S

Mass

720.24

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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

N-acyl-alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenylpiperazine - N-arylpiperazine - Chromone - Amphetamine or derivatives - Benzopyran - Sulfanilide - 1-benzopyran - 2-heteroaryl carboxamide - Aniline or substituted anilines - Dialkylarylamine - Chlorobenzene - Halobenzene - Pyranone - 1,4-diazinane - Monocyclic benzene moiety - Piperazine - Aryl halide - Pyran - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Organosulfonic acid amide - Organic sulfonic acid amide - Benzenoid - Aryl chloride - Heteroaromatic compound - Organosulfonic acid or derivatives - Pyrrolidine - Sulfonyl - Organic sulfonic acid or derivatives - Tertiary carboxylic acid amide - Aminosulfonyl compound - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Lactam - Organoheterocyclic compound - Oxacycle - Azacycle - Amine - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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