Structure Information
Structure

Compound Identification

SMILES

CSC1=NC=C(CO)N1CC1=CC=C(NC(C([O-])=O)C2=CC=CC=C2Cl)C=C1

InChIKey

InChIKey=PRMSCTKJRDZGON-UHFFFAOYSA-M

Formula

C20H19ClN3O3S

Mass

416.9

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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 - Secondary aliphatic/aromatic amine - Halobenzene - Chlorobenzene - Alkylarylthioether - Aralkylamine - Benzenoid - Aryl chloride - N-substituted imidazole - Monocyclic benzene moiety - Aryl halide - Imidazole - Heteroaromatic compound - Azole - Carboxylic acid salt - Amino acid - Azacycle - Organoheterocyclic compound - Carboxylic acid - Sulfenyl compound - Thioether - Secondary amine - Monocarboxylic acid or derivatives - Organic oxide - Aromatic alcohol - Amine - Organic oxygen compound - Carbonyl group - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Primary alcohol - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic anion - 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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