Structure Information
Structure

Compound Identification

SMILES

CCCCOC1=C(OCC)C=C(C=C1)C1N(C2=NC(C)=C(S2)C(C)=O)C(=O)C(=O)C1=C(O)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=BTRUBUPLOXIWNW-UHFFFAOYSA-N

Formula

C29H29ClN2O6S

Mass

569.07

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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

2-phenylpyrrolidine - 2,4,5-trisubstituted 1,3-thiazole - Phenol ether - Aryl ketone - Aryl alkyl ketone - Phenoxy compound - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl halide - Aryl chloride - Benzenoid - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - Monocyclic benzene moiety - Vinylogous acid - Heteroaromatic compound - Azole - Thiazole - Tertiary carboxylic acid amide - Pyrrole - Cyclic ketone - Carboxamide group - Ketone - Lactam - Ether - Enol - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - 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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