Structure Information
Structure

Compound Identification

SMILES

CN1C(=S)SC(N2OC3C(C2C2=CC(=CC=C2)[N+]([O-])=O)C(=O)N(C3=O)C2=CC=CC=C2)C1(C)C

InChIKey

InChIKey=XCPXSWDILTVGFP-UHFFFAOYSA-N

Formula

C23H22N4O5S2

Mass

498.57

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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

Phenylisoxazolidine - 1-phenylpyrrolidine - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - Thiazolidinethione - Benzenoid - Carboxylic acid imide - Dicarboximide - Isoxazolidine - Cyclic dithiocarbamic acid ester - Pyrrole - Thiazolidine - Dithiocarbamic acid ester - Organic nitro compound - Lactam - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - N-organohydroxylamine - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Oxacycle - Organic oxygen compound - Organic salt - Carbonyl group - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen 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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