Structure Information
Structure

Compound Identification

SMILES

CC(C)CC(N)C1=NC(=CS1)C(=O)NC1CCSC1=O

InChIKey

InChIKey=ZMRAYRPWMDRWBW-UHFFFAOYSA-N

Formula

C13H19N3O2S2

Mass

313.43

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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

N-acyl-alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - 2-heteroaryl carboxamide - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Aralkylamine - Heteroaromatic compound - Azole - Thiazole - Carbothioic s-lactone - Thiolane - Carboxamide group - Secondary carboxylic acid amide - Thiocarboxylic acid ester - Thiolactone - Azacycle - Organoheterocyclic compound - Thiocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Carbonyl group - Amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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