Compound Identification
SMILES
CC1=C(N2C=CC=CC2=N1)C(O)=C1C(N(C2=NN=C(SCC3=CC=CC=C3Cl)S2)C(=O)C1=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=CQXHUHRYSPXYMG-UHFFFAOYSA-N
Formula
C29H22ClN5O3S2
Mass
588.1
Taxonomic Classification
Taxonomy Tree
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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
Imidazo[1,2-a]pyridines Imidazopyridines Alkylarylthioethers Toluenes Chlorobenzenes Aryl chlorides Pyrrolidine-3-ones Pyrrolidine-2-ones Pyridines and derivatives N-substituted imidazoles Vinylogous acids Thiadiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Pyrroles Cyclic ketones Lactams Sulfenyl compounds Azacyclic compounds Enols Hydrocarbon derivatives Organonitrogen compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Imidazo[1,2-a]pyridine - Imidazopyridine - Aryl thioether - Chlorobenzene - Halobenzene - Toluene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Pyridine - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Benzenoid - Vinylogous acid - Pyrrole - Heteroaromatic compound - Thiadiazole - Tertiary carboxylic acid amide - Imidazole - Azole - Carboxamide group - Cyclic ketone - Ketone - Lactam - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Thioether - Enol - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen 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