Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)C1=NN([C@H](C1)C1=CC=C(Br)C=C1)C(=N)S[C@H]1CC(=O)N(C1=O)C1=CC(Cl)=CC(Cl)=C1

InChIKey

InChIKey=RXHJMBIXIWXVOT-RPWUZVMVSA-N

Formula

C27H21BrCl2N4O2S

Mass

616.36

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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

Dichlorobenzenes Toluenes Bromobenzenes Pyrrolidine-2-ones Aryl bromides Aryl chlorides N-substituted carboxylic acid imides Pyrroles Pyrazolines Dicarboximides Lactams Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Imines Organic oxides Organobromides Organochlorides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1-phenylpyrrolidine - 1,3-dichlorobenzene - Bromobenzene - Chlorobenzene - Toluene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Carboxylic acid imide - Dicarboximide - Pyrrole - Pyrazoline - Lactam - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Imine - Organosulfur compound - Carbonyl group - Organohalogen compound - Hydrocarbon derivative - Organobromide - Organochloride - Organonitrogen compound - 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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