Compound Identification
SMILES
COC1=C(Cl)C=C(C=C1)N1C(=O)CC(NNC(=O)CSC2=CC=C(C)C=C2)C1=O
InChIKey
InChIKey=YNLINEPHSCDWFW-UHFFFAOYSA-N
Formula
C20H20ClN3O4S
Mass
433.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
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
Alpha amino acids and derivatives Methoxyanilines Anisoles Thiophenol ethers Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Alkylarylthioethers Toluenes Pyrrolidine-2-ones Aryl chlorides N-substituted carboxylic acid imides Dicarboximides Pyrroles Carboxylic acid hydrazides Lactams Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organochlorides Carbonyl compounds Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Alpha-amino acid or derivatives - Methoxyaniline - Phenoxy compound - Aryl thioether - Anisole - Phenol ether - Methoxybenzene - Thiophenol ether - Alkyl aryl ether - Alkylarylthioether - Halobenzene - Chlorobenzene - Toluene - Monocyclic benzene moiety - 2-pyrrolidone - Pyrrolidone - Benzenoid - Aryl halide - Aryl chloride - Carboxylic acid imide, n-substituted - Carboxylic acid imide - Dicarboximide - Pyrrole - Carboxylic acid hydrazide - Lactam - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Thioether - Ether - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - 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