Structure Information
Structure

Compound Identification

SMILES

CC1=NC(SCC(=O)N2CC[NH+](CC3=CC=CS3)CC2)=C(C#N)C(C)=C1

InChIKey

InChIKey=MDERXCPXTNOLJA-UHFFFAOYSA-O

Formula

C19H23N4OS2

Mass

387.54

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organosulfur compounds

Class

Thioethers

Subclass

Aryl thioethers

Intermediate Tree Nodes

Not available

Direct Parent

Aryl thioethers

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl thioether - 3-pyridinecarbonitrile - N-alkylpiperazine - Alkylarylthioether - Aralkylamine - Methylpyridine - 1,4-diazinane - Piperazine - Pyridine - Thiophene - Tertiary carboxylic acid amide - Quaternary ammonium salt - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Amino acid or derivatives - Carboxylic acid derivative - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Amine - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.

External Descriptors

Not available

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