Compound Identification
SMILES
CCS(=O)(=O)N[C@@H]1CC2(C)OC1(C)[C@H]1[C@@H]2C(=O)N(C1=O)C1=CC(=C(C=C1)C#N)C(F)(F)F
InChIKey
InChIKey=HYNANJUKEMCYEQ-UMWKCDSESA-N
Formula
C20H20F3N3O5S
Mass
471.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
-
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
Trifluoromethylbenzenes Isoindolones Benzonitriles Pyrrolidine-2-ones N-substituted carboxylic acid imides Organic sulfonamides Organosulfonamides Aminosulfonyl compounds Pyrroles Dicarboximides Oxolanes Lactams Azacyclic compounds Nitriles Dialkyl ethers Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Trifluoromethylbenzene - Isoindolone - Isoindole or derivatives - Isoindoline - Benzonitrile - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Pyrrole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Oxolane - Sulfonyl - Aminosulfonyl compound - Carboxylic acid imide - Dicarboximide - Lactam - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Azacycle - Carbonitrile - Nitrile - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Alkyl halide - Cyanide - Organosulfur compound - Organooxygen compound - Carbonyl group - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen 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