Compound Identification
SMILES
CCOC1=C(OCC(=O)NC2=CC=C(OC)C=C2)C=CC(=C1)[C@H]1[C@H]2[C@H]3C[C@@H]([C@H]2SC2=C1SC(=O)N2)[C@H]1[C@H]3C(=O)N(C1=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=XUIGHCHLZONSFM-SULZKXAKSA-N
Formula
C37H35N3O7S2
Mass
697.82
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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
Aromatic monoterpenoids Isoindolones Anilides Methoxyanilines Phenoxy compounds Anisoles N-arylamides Methoxybenzenes Toluenes Alkyl aryl ethers Alkylarylthioethers Thiopyrans Pyrrolidine-2-ones N-substituted carboxylic acid imides Thiazoles Pyrroles Dicarboximides Heteroaromatic compounds Lactams Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Monoterpenoid - Isoindolone - Norbornane monoterpenoid - Aromatic monoterpenoid - Anilide - Methoxyaniline - Isoindole or derivatives - Isoindoline - Methoxybenzene - Phenol ether - N-arylamide - Aryl thioether - Phenoxy compound - Anisole - Alkyl aryl ether - Alkylarylthioether - Toluene - Benzenoid - Thiopyran - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - Monocyclic benzene moiety - Azole - Carboxylic acid imide - Dicarboximide - Heteroaromatic compound - Thiazole - Pyrrole - Carboxamide group - Lactam - Secondary carboxylic acid amide - Thioether - Azacycle - Ether - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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