Structure Information
Structure

Compound Identification

SMILES

CCC1=CC2=C(C=C1)N=C(S2)N1[C@@H](C(=C(O)C2=CC=C(F)C=C2)C(=O)C1=O)C1=CC=C(C=C1)C(C)(C)C

InChIKey

InChIKey=PAYNYEPXUNPBGQ-RUZDIDTESA-N

Formula

C30H27FN2O3S

Mass

514.62

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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 - Phenylpropane - 1,3-benzothiazole - Halobenzene - Fluorobenzene - Monocyclic benzene moiety - Aryl halide - Benzenoid - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - Aryl fluoride - Heteroaromatic compound - Vinylogous acid - Azole - Thiazole - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Lactam - Cyclic ketone - Ketone - Azacycle - Carboxylic acid derivative - Enol - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organofluoride - 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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