Structure Information
Structure

Compound Identification

SMILES

CC1=C(Br)C=CC(=C1)N1C(=O)[C@@H]2[C@@H]([C@@H]3CS[C@H]2CC3=O)C1=O

InChIKey

InChIKey=IKSXEALVWQQBEU-PCDDKUFXSA-N

Formula

C16H14BrNO3S

Mass

380.26

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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

Isoindolones Toluenes Bromobenzenes Thianes Pyrrolidine-2-ones Aryl bromides N-substituted carboxylic acid imides Pyrroles Dicarboximides Lactams Ketones Dialkylthioethers Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-phenylpyrrolidine - Isoindolone - Isoindole or derivatives - Isoindoline - Bromobenzene - Halobenzene - Toluene - Carboxylic acid imide, n-substituted - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrrolidone - Benzenoid - Thiane - 2-pyrrolidone - Carboxylic acid imide - Dicarboximide - Pyrrole - Ketone - Lactam - Carboxylic acid derivative - Azacycle - Dialkylthioether - Thioether - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen 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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