Structure Information
Structure

Compound Identification

SMILES

C(SC1=NSN=C1[C@H]1CN2C[C@@H]1CCC2)C#CC1=CC=CC=C1

InChIKey

InChIKey=HCABSDMEPTYQBN-HOTGVXAUSA-N

Formula

C18H19N3S2

Mass

341.49

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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

Azepanes Aralkylamines Alkylarylthioethers Piperidines N-alkylpyrrolidines Benzene and substituted derivatives Thiadiazoles Heteroaromatic compounds Trialkylamines Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aryl thioether - Azepane - Aralkylamine - Alkylarylthioether - Monocyclic benzene moiety - Piperidine - Benzenoid - N-alkylpyrrolidine - Azole - Heteroaromatic compound - Pyrrolidine - Thiadiazole - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic 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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