Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C1N(C(=O)C(=O)\C1=C(\O)C1=C(C)N=C2C=CC=CN12)C1=NN=C(SCC2=C(Cl)C=C(Cl)C=C2)S1
InChIKey
InChIKey=LGQXCJCAXBWYLU-WNAAXNPUSA-N
Formula
C30H23Cl2N5O5S2
Mass
668.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
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
Dimethoxybenzenes Imidazo[1,2-a]pyridines Imidazopyridines Anisoles Dichlorobenzenes Phenoxy compounds Alkyl aryl ethers Alkylarylthioethers Aryl chlorides Pyrrolidine-3-ones Pyrrolidine-2-ones N-substituted imidazoles Pyridines and derivatives Pyrroles Tertiary carboxylic acid amides Heteroaromatic compounds Thiadiazoles Vinylogous acids Lactams Cyclic ketones Enols Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - O-dimethoxybenzene - Dimethoxybenzene - Imidazo[1,2-a]pyridine - Imidazopyridine - Phenoxy compound - Aryl thioether - Anisole - Phenol ether - Methoxybenzene - 1,3-dichlorobenzene - Alkyl aryl ether - Chlorobenzene - Alkylarylthioether - Halobenzene - Benzenoid - Monocyclic benzene moiety - N-substituted imidazole - Aryl halide - Aryl chloride - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - Pyridine - Azole - Heteroaromatic compound - Vinylogous acid - Imidazole - Thiadiazole - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Lactam - Ketone - Cyclic ketone - Thioether - Sulfenyl compound - Carboxylic acid derivative - Ether - Enol - Azacycle - Organic oxygen compound - Organic oxide - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen 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