Compound Identification
SMILES
FC1=CC=C(C=C1)C1=NC(CC(=O)OC2=CC=C(C=C2)N2CCCC2=O)=CS1
InChIKey
InChIKey=OYJMQHKJAVWQIE-UHFFFAOYSA-N
Formula
C21H17FN2O3S
Mass
396.44
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
Phenol esters Phenoxy compounds 2,4-disubstituted thiazoles Fluorobenzenes Pyrrolidine-2-ones Aryl fluorides Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Tertiary amines Amino acids and derivatives Carboxylic acid esters Lactams Monocarboxylic acids and derivatives Azacyclic compounds Organofluorides Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Phenol ester - Phenoxy compound - 2,4-disubstituted 1,3-thiazole - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrrolidone - 2-pyrrolidone - Tertiary carboxylic acid amide - Pyrrole - Thiazole - Heteroaromatic compound - Azole - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Tertiary amine - Lactam - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organooxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen 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