Compound Identification
SMILES
COC1=C(C=C(C=C1)S(=O)(=O)NC1=CC(Br)=CC(F)=C1OC)N1CC2CN(C)CC2C1
InChIKey
InChIKey=PNLCBWDACKKONT-UHFFFAOYSA-N
Formula
C21H25BrFN3O4S
Mass
514.41
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Aminobenzenesulfonamides Sulfanilides Benzenesulfonyl compounds Methoxyanilines Aminophenyl ethers Anisoles Phenoxy compounds Dialkylarylamines Methoxybenzenes Bromobenzenes Fluorobenzenes Alkyl aryl ethers Aryl bromides Organosulfonamides Aryl fluorides N-alkylpyrrolidines Pyrroles Aminosulfonyl compounds Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aminobenzenesulfonamide - 1-phenylpyrrolidine - Benzenesulfonamide - Sulfanilide - Aminophenyl ether - Benzenesulfonyl group - Methoxyaniline - Anisole - Phenoxy compound - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl bromide - Benzenoid - N-alkylpyrrolidine - Organosulfonic acid amide - Aryl halide - Monocyclic benzene moiety - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrole - Tertiary aliphatic amine - Tertiary amine - Ether - Azacycle - Organobromide - Organohalogen compound - Organic oxygen compound - Organic oxide - Amine - Hydrocarbon derivative - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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