Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(=C1)C(O)=C1C(N(C2=NC3=C(S2)C=C(Cl)C=C3)C(=O)C1=O)C1=CC(Br)=CC=C1

InChIKey

InChIKey=GQWSJJFAQSCPIT-UHFFFAOYSA-N

Formula

C25H16BrClN2O4S

Mass

555.83

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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

2-phenylpyrrolidine - 1,3-benzothiazole - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Halobenzene - Bromobenzene - Aryl bromide - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Benzenoid - Vinylogous acid - Azole - Heteroaromatic compound - Pyrrole - Tertiary carboxylic acid amide - Thiazole - Carboxamide group - Ketone - Lactam - Cyclic ketone - Azacycle - Ether - Enol - Carboxylic acid derivative - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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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