Structure Information
Structure

Compound Identification

SMILES

[Na+].[O-]S(=O)(=O)C1=CC=C(NC(=S)C2SC(=S)N(C2=O)C2=CC=CC(=C2)C(F)(F)F)O1

InChIKey

InChIKey=ASNWODZWBDMNSO-UHFFFAOYSA-M

Formula

C15H8F3N2NaO5S4

Mass

504.46

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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 - Trifluoromethylbenzene - Arylsulfonic acid or derivatives - Monocyclic benzene moiety - Thiazolidinethione - Benzenoid - Thiazolidine - Thioamide - Sulfonyl - Organosulfonic acid - Furan - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Tertiary amine - Thiocarboxylic acid amide - Organoheterocyclic compound - Organic alkali metal salt - Azacycle - Oxacycle - Organic metal halide - Alkyl fluoride - Alkyl halide - Thiocarbonyl group - Organic salt - Organic sodium salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Organic cation - 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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