Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=CC=C1NC(=O)CCN1C(=S)SC(=CC2=CC=CC=C2)C1=O

InChIKey

InChIKey=JKMSWTOVDSWYPY-UHFFFAOYSA-N

Formula

C19H15ClN2O2S2

Mass

402.91

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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

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Beta amino acid or derivatives - Anilide - N-arylamide - Chlorobenzene - Halobenzene - Aryl halide - Benzenoid - Thiazolidinethione - Monocyclic benzene moiety - Aryl chloride - Dithiocarbamic acid ester - Cyclic dithiocarbamic acid ester - Thiazolidine - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Organic oxide - Organochloride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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