Compound Identification
SMILES
ClC1=CC=C(C=C1)N1C(=O)[C@@H]2[C@H]3CSC[NH+]3[C@H](\C=C\C3=CC=CC=C3)[C@@H]2C1=O
InChIKey
InChIKey=UNKLTRXXWKZTPX-UOIOJPBHSA-O
Formula
C22H20ClN2O2S
Mass
411.92
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Beta amino acids and derivatives Styrenes Pyrrolothiazoles Chlorobenzenes Aryl chlorides N-alkylpyrrolidines N-substituted carboxylic acid imides Pyrrolidine-2-ones Dicarboximides Quaternary ammonium salts Pyrroles Thiazolidines Lactams Azacyclic compounds Dialkylthioethers Amines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - 1-phenylpyrrolidine - Pyrrolothiazole - Styrene - Chlorobenzene - Halobenzene - Benzenoid - Carboxylic acid imide, n-substituted - N-alkylpyrrolidine - Monocyclic benzene moiety - Aryl halide - Pyrrolidone - 2-pyrrolidone - Aryl chloride - Dicarboximide - Carboxylic acid imide - Thiazolidine - Pyrrole - Quaternary ammonium salt - Lactam - Thioether - Azacycle - Dialkylthioether - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Amine - Organochloride - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Organic cation - 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