Structure Information
Structure

Compound Identification

SMILES

CSC1(NNC(=C)C(=O)N1)[NH2+]CC1=CC=C(Cl)C=C1

InChIKey

InChIKey=OCTZAZOHAXFVPQ-UHFFFAOYSA-O

Formula

C12H16ClN4OS

Mass

299.8

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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 heteromonocyclic compounds

Substituents

Alpha-amino acid or derivatives - Chlorobenzene - Halobenzene - 1,2,4-triazinane - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Triazinane - Triazine - Benzenoid - 1,2,4-triazine - Quaternary ammonium salt - Carboxamide group - Secondary carboxylic acid amide - Ortho amide - Lactam - Sulfenyl compound - Azacycle - Thioether - Organoheterocyclic compound - Dialkylthioether - Alkylhydrazine - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Hydrazine derivative - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic 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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