Compound Identification
SMILES
CSC1=CC=CC(=C1)[C@H]1[C@@H](N2C=CC3=CC=CC=C3[C@H]2C1(C#N)C#N)C(=O)C12CC3CC(CC(C3)C1)C2
InChIKey
InChIKey=RNHQHVKQKIBRAK-SOHPDCFESA-N
Formula
C32H31N3OS
Mass
505.68
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Thiophenol ethers Aralkylamines Alkylarylthioethers Benzene and substituted derivatives Pyrroles Alpha-amino ketones Trialkylamines Sulfenyl compounds Nitriles Enamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrolidine - Aryl thioether - Thiophenol ether - Aralkylamine - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Alpha-aminoketone - Pyrrole - Ketone - Tertiary amine - Tertiary aliphatic amine - Azacycle - Thioether - Sulfenyl compound - Enamine - Carbonitrile - Nitrile - Amine - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Cyanide - Organic nitrogen compound - Organic oxide - Carbonyl group - Organic oxygen 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