Compound Identification
SMILES
COC1=CC=CC(=C1)C1N(C2=NC3=C(S2)C=C(F)C=C3)C(=O)C(=O)C1=C(O)C1=CC=C(F)C=C1
InChIKey
InChIKey=KVTOQCYVRDYYEY-UHFFFAOYSA-N
Formula
C25H16F2N2O4S
Mass
478.47
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 Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Fluorobenzenes Aryl fluorides Pyrrolidine-3-ones Pyrrolidine-2-ones Vinylogous acids Thiazoles Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Cyclic ketones Lactams Enols Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - 1,3-benzothiazole - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - Heteroaromatic compound - Azole - Vinylogous acid - Thiazole - Pyrrole - Tertiary carboxylic acid amide - Cyclic ketone - Ketone - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Enol - Ether - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - 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