Structure Information
Structure

Compound Identification

SMILES

O=C([C@@H]1[C@H]([C@H]2CSCN2[C@@]11C(=O)NC2=CC=CC=C12)C1=CC=CC=C1)C1=CC2=C(OCO2)C=C1

InChIKey

InChIKey=KLXOMDQDFSGCLW-MBPYSEENSA-N

Formula

C27H22N2O4S

Mass

470.54

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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 heteropolycyclic compounds

Substituents

3-phenylpyrrolidine - Alpha-amino acid or derivatives - Benzodioxole - Indole or derivatives - Dihydroindole - Pyrrolothiazole - Aryl alkyl ketone - Aryl ketone - Monocyclic benzene moiety - Gamma-aminoketone - Benzenoid - N-alkylpyrrolidine - Pyrrole - Thiazolidine - Secondary carboxylic acid amide - Carboxamide group - Lactam - Ketone - Hemithioaminal - Dialkylthioether - Acetal - Azacycle - Thioether - Oxacycle - Carboxylic acid derivative - Aldehyde - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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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