Structure Information
Structure

Compound Identification

SMILES

[Na+].CCCSC1=NC=C(CO)N1CC1=CC=C(NC(C([O-])=O)C2=CC=CC=C2Cl)C=C1

InChIKey

InChIKey=QPFTZLGAISJRRF-UHFFFAOYSA-M

Formula

C22H23ClN3NaO3S

Mass

467.94

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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 acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-amino acid - 1,2,5-trisubstituted-imidazole - Aryl thioether - Imidazolyl carboxylic acid derivative - Trisubstituted imidazole - Aniline or substituted anilines - Phenylalkylamine - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Alkylarylthioether - Aralkylamine - N-substituted imidazole - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Imidazole - Heteroaromatic compound - Azole - Carboxylic acid salt - Amino acid - Organoheterocyclic compound - Organic metal halide - Thioether - Secondary amine - Monocarboxylic acid or derivatives - Carboxylic acid - Sulfenyl compound - Azacycle - Organic alkali metal salt - Organic salt - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Alcohol - Organic nitrogen compound - Organosulfur compound - Primary alcohol - Carbonyl group - Organic oxygen compound - Organic oxide - Aromatic alcohol - Organic zwitterion - Hydrocarbon derivative - Organic sodium salt - Amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).

External Descriptors

Not available

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