Compound Identification
SMILES
[O-][N+](=O)C1C2CSCN2[C@]2(C1C1=CC(Cl)=CC=C1)C(=O)NC1=CC=CC=C21
InChIKey
InChIKey=VPJKSHAKFFWUBV-MAGNIPBMSA-N
Formula
C19H16ClN3O3S
Mass
401.87
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Alpha amino acids and derivatives Indolines Pyrrolothiazoles Chlorobenzenes Aryl chlorides N-alkylpyrrolidines Thiazolidines Pyrroles Secondary carboxylic acid amides C-nitro compounds Lactams Thiohemiaminal derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Dialkylthioethers Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic zwitterions Amines Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrolidine - Alpha-amino acid or derivatives - Indole or derivatives - Dihydroindole - Pyrrolothiazole - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Thiazolidine - Pyrrole - Organic nitro compound - Carboxamide group - Lactam - C-nitro compound - Secondary carboxylic acid amide - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Hemithioaminal - Thioether - Organic oxoazanium - Azacycle - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Organic salt - Carbonyl group - Organohalogen compound - Organic zwitterion - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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