Compound Identification
SMILES
COC1=CC=C(C=C1)N1C(=O)C2C3CC(C4C3SC3=C(SC(=O)N3)[C@@H]4C3=CC=CO3)C2C1=O
InChIKey
InChIKey=XMLXXYATDADOCW-JMTFNUOPSA-N
Formula
C24H20N2O5S2
Mass
480.55
Taxonomic Classification
Taxonomy Tree
-
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
Aromatic monoterpenoids Isoindolones Methoxyanilines Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Alkylarylthioethers Thiopyrans Pyrrolidine-2-ones N-substituted carboxylic acid imides Thiazoles Dicarboximides Furans Pyrroles Heteroaromatic compounds Lactams Azacyclic compounds Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Aromatic monoterpenoid - Isoindolone - Monoterpenoid - Norbornane monoterpenoid - Isoindoline - Isoindole or derivatives - Methoxyaniline - Anisole - Phenoxy compound - Aryl thioether - Phenol ether - Methoxybenzene - Alkyl aryl ether - Alkylarylthioether - Benzenoid - Thiopyran - Monocyclic benzene moiety - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Carboxylic acid imide - Dicarboximide - Furan - Thiazole - Pyrrole - Heteroaromatic compound - Azole - Lactam - Thioether - Oxacycle - Carboxylic acid derivative - Ether - Azacycle - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen 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