Structure Information
Structure

Compound Identification

SMILES

COCCNC(=O)C1=C(C=CC(NC(=O)NC2=CC=C(SC)C=C2)=C1)N1CCCC1

InChIKey

InChIKey=RMPUKUZCNPWUAE-UHFFFAOYSA-N

Formula

C22H28N4O3S

Mass

428.55

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolidines

Subclass

Phenylpyrrolidines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrrolidines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1-phenylpyrrolidine - Aminobenzamide - Anthranilamide - Aminobenzoic acid or derivatives - N-phenylurea - 2-aminobenzamide - Benzamide - Benzoic acid or derivatives - Tertiary aliphatic/aromatic amine - Aryl thioether - Thiophenol ether - Benzoyl - Dialkylarylamine - Aniline or substituted anilines - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Vinylogous amide - Pyrrole - Amino acid or derivatives - Carboxamide group - Urea - Tertiary amine - Secondary carboxylic acid amide - Ether - Dialkyl ether - Carboxylic acid derivative - Sulfenyl compound - Azacycle - Thioether - Organonitrogen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.

External Descriptors

Not available

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