Structure Information
Structure

Compound Identification

SMILES

CN1C(=S)NC(CC2=CNC3=C2C=CC=C3Cl)C1=O

InChIKey

InChIKey=OKOAUGRWEJDVCB-UHFFFAOYSA-N

Formula

C13H12ClN3OS

Mass

293.77

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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

Alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid or derivatives - 3-alkylindole - Indole - Indole or derivatives - Aryl chloride - Aryl halide - Imidazolidinone - Benzenoid - Substituted pyrrole - Imidazolidine - Heteroaromatic compound - Pyrrole - Thiourea - Azacycle - Organoheterocyclic compound - Organochloride - Organohalogen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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