Compound Identification
SMILES
CCOC(=O)C1=C(C)N=C(S1)N1C(C(=C(O)C2=CC=CC=C2)C(=O)C1=O)C1=CC=C(C=C1)C(C)(C)C
InChIKey
InChIKey=RFGCWRKWZAGKMH-UHFFFAOYSA-N
Formula
C28H28N2O5S
Mass
504.6
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
Phenylpropanes Thiazolecarboxylic acids and derivatives 2,4,5-trisubstituted thiazoles Pyrrolidine-3-ones Pyrrolidine-2-ones Vinylogous acids Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Carboxylic acid esters Lactams Cyclic ketones Azacyclic compounds Enols Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenylpropane - 2,4,5-trisubstituted 1,3-thiazole - Thiazolecarboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - Azole - Heteroaromatic compound - Vinylogous acid - Pyrrole - Thiazole - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Cyclic ketone - Enol - Carboxylic acid derivative - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - 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