Compound Identification
SMILES
COC1=CC2=C(C=C1)N=C(S2)N1C(C(C(=O)C2=CC=CS2)C(=O)C1=O)C1=CC=C(F)C=C1
InChIKey
InChIKey=QANMWEDTVXTWQA-UHFFFAOYSA-N
Formula
C23H15FN2O4S2
Mass
466.5
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
Benzothiazoles Anisoles Aryl alkyl ketones Alkyl aryl ethers Beta-diketones Fluorobenzenes Pyrrolidine-3-ones Pyrrolidine-2-ones Aryl fluorides Thiophenes Thiazoles Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Cyclic ketones Lactams Azacyclic compounds Organofluorides Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - 1,3-benzothiazole - Anisole - Phenol ether - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Halobenzene - Fluorobenzene - 1,3-diketone - Aryl fluoride - Aryl halide - Benzenoid - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Monocyclic benzene moiety - 1,3-dicarbonyl compound - Pyrrole - Tertiary carboxylic acid amide - Thiazole - Thiophene - Azole - Heteroaromatic compound - Cyclic ketone - Carboxamide group - Ketone - Lactam - Ether - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organofluoride - Organic oxide - Organohalogen 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