Compound Identification
SMILES
OC(=O)C1=C(S[C@H]2CC(=O)N(C2=O)C2=CC=C(F)C=C2)N=CC=C1
InChIKey
InChIKey=BCHNMCGVLWTFRJ-LBPRGKRZSA-N
Formula
C16H11FN2O4S
Mass
346.33
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
Pyridinecarboxylic acids Alkylarylthioethers Fluorobenzenes Vinylogous thioesters Pyrrolidine-2-ones Aryl fluorides N-substituted carboxylic acid imides Pyrroles Dicarboximides Heteroaromatic compounds Lactams Sulfenyl compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organonitrogen compounds Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Aryl thioether - Fluorobenzene - Halobenzene - Alkylarylthioether - Monocyclic benzene moiety - Vinylogous thioester - Aryl halide - Benzenoid - Aryl fluoride - Carboxylic acid imide, n-substituted - 2-pyrrolidone - Pyrrolidone - Pyridine - Heteroaromatic compound - Carboxylic acid imide - Dicarboximide - Pyrrole - Lactam - Azacycle - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Organosulfur compound - Organohalogen compound - Organofluoride - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - 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