Compound Identification
SMILES
CN1C(SCC(=O)N2CCC[C@H]2C2=CC3=C(OCCO3)C=C2)=NN=C1[C@@H]1COC2=CC=CC=C2O1
InChIKey
InChIKey=MXVMZFLQRYLGHQ-JTSKRJEESA-N
Formula
C25H26N4O5S
Mass
494.57
Taxonomic Classification
Taxonomy Tree
-
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
Benzo-1,4-dioxanes N-acylpyrrolidines Alkyl aryl ethers Alkylarylthioethers Para dioxins Benzenoids Pyrroles Heteroaromatic compounds Triazoles Tertiary carboxylic acid amides Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Benzo-1,4-dioxane - Benzodioxane - Aryl thioether - N-acylpyrrolidine - Alkyl aryl ether - Alkylarylthioether - Benzenoid - Para-dioxin - Azole - Heteroaromatic compound - 1,2,4-triazole - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Oxacycle - Carboxylic acid derivative - Ether - Azacycle - Sulfenyl compound - Thioether - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - 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