Compound Identification
SMILES
CS(=O)(=O)N[C@@H]1CCN(C1)C1=C(F)C=C(C=C1)N1C[C@H](COC2=NOC=C2)OC1=O
InChIKey
InChIKey=AGKRXCHPSCJACM-TZMCWYRMSA-N
Formula
C18H21FN4O6S
Mass
440.45
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
Aniline and substituted anilines Dialkylarylamines Alkyl aryl ethers Fluorobenzenes Oxazolidinones Organosulfonamides Organic sulfonamides Aryl fluorides Pyrroles Aminosulfonyl compounds Isoxazoles Heteroaromatic compounds Carbamate esters Organic carbonic acids and derivatives Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Oxazolidinone - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Sulfonyl - Azole - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrole - Heteroaromatic compound - Aminosulfonyl compound - Oxazolidine - Carbamic acid ester - Isoxazole - Tertiary amine - Carbonic acid derivative - Azacycle - Oxacycle - Ether - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxide - Amine - 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