Structure Information
Structure

Compound Identification

SMILES

COC(=O)CCC1=CC=C(C=C1)N1CCN(C1=O)C1=C(SC)C=C(C=C1)C#N

InChIKey

InChIKey=BHSDEWKYRGQANZ-UHFFFAOYSA-N

Formula

C21H21N3O3S

Mass

395.48

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azolidines

Subclass

Imidazolidines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylimidazolidines

Alternative Parents

Thiophenol ethers Benzonitriles Fatty acid esters Alkylarylthioethers Imidazolidinones Methyl esters Ureas Sulfenyl compounds Nitriles Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylimidazolidine - Benzonitrile - Aryl thioether - Thiophenol ether - Fatty acid ester - Alkylarylthioether - Monocyclic benzene moiety - Imidazolidinone - Benzenoid - Fatty acyl - Methyl ester - Carboxylic acid ester - Urea - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Thioether - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Cyanide - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylimidazolidines. These are polycyclic compounds containing an imidazoline substituted by a phenyl group.

External Descriptors

Not available

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