Compound Identification
SMILES
CC(C)(C)N1C[C@H]([C@@H](C1)C1=C(F)C=C(F)C=C1)C(=O)N1CCN(CC1)C(CNS(C)(=O)=O)C1CCCCC1
InChIKey
InChIKey=KTROLWWNGLLSOQ-GPTJOGTASA-N
Formula
C28H44F2N4O3S
Mass
554.74
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
Pyrrolidinecarboxamides Aralkylamines Fluorobenzenes N-alkylpiperazines Aryl fluorides N-alkylpyrrolidines Organic sulfonamides Organosulfonamides Aminosulfonyl compounds Pyrroles Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-phenylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-3-carboxamide - Fluorobenzene - Halobenzene - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Monocyclic benzene moiety - Piperazine - Aryl halide - Benzenoid - Organic sulfonic acid amide - Organosulfonic acid amide - Aryl fluoride - N-alkylpyrrolidine - Pyrrole - Organosulfonic acid or derivatives - Sulfonyl - Tertiary carboxylic acid amide - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxamide group - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Amine - Organooxygen compound - Hydrocarbon derivative - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organohalogen compound - Organofluoride - Aromatic heteromonocyclic 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