Compound Identification
SMILES
CC1=C(N2C=CC=CC2=N1)C(O)=C1C(N(C2=NN=C(SCC3=C(Cl)C=C(Cl)C=C3)S2)C(=O)C1=O)C1=CC(O)=CC=C1
InChIKey
InChIKey=KKRAGGNGSXCELF-UHFFFAOYSA-N
Formula
C28H19Cl2N5O4S2
Mass
624.51
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
Imidazo[1,2-a]pyridines Imidazopyridines Dichlorobenzenes 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkylarylthioethers Aryl chlorides Pyrrolidine-3-ones Pyrrolidine-2-ones Pyridines and derivatives N-substituted imidazoles Vinylogous acids Thiadiazoles Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Cyclic ketones Lactams Azacyclic compounds Enols Sulfenyl compounds Hydrocarbon derivatives Organonitrogen compounds Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Imidazopyridine - Imidazo[1,2-a]pyridine - 1,3-dichlorobenzene - Aryl thioether - Chlorobenzene - Halobenzene - 1-hydroxy-4-unsubstituted benzenoid - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Alkylarylthioether - Aryl chloride - Benzenoid - Aryl halide - N-substituted imidazole - Monocyclic benzene moiety - Pyridine - Pyrrolidone - 3-pyrrolidone - 2-pyrrolidone - Heteroaromatic compound - Imidazole - Vinylogous acid - Azole - Thiadiazole - Pyrrole - Tertiary carboxylic acid amide - Carboxamide group - Cyclic ketone - Ketone - Lactam - Carboxylic acid derivative - Azacycle - Thioether - Sulfenyl compound - Enol - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - 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