Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(CCN)NC(SCC2=CC=CC=N2)=N1

InChIKey

InChIKey=KAIAJGICOZJGKI-UHFFFAOYSA-N

Formula

C13H16N4O2S

Mass

292.36

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Imidazoles

Intermediate Tree Nodes

Substituted imidazoles - Trisubstituted imidazoles

Direct Parent

2,4,5-trisubstituted imidazoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2,4,5-trisubstituted-imidazole - Aryl thioether - 2-arylethylamine - Imidazole-4-carbonyl group - Aralkylamine - Alkylarylthioether - Pyridine - Heteroaromatic compound - Vinylogous amide - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Thioether - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Primary amine - Amine - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 2,4,5-trisubstituted imidazoles. These are imidazoles in which the imidazole ring is substituted at positions 2, 4, and 5.

External Descriptors

Not available

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