Compound Identification
SMILES
CCCCOC1=CC=CC(=C1)C1N(C2=NC=CS2)C(=O)C(=O)C1=C(O)C1=CC=NC=C1
InChIKey
InChIKey=IYYDRDUCTWLOIW-UHFFFAOYSA-N
Formula
C23H21N3O4S
Mass
435.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Phenol ethers Phenoxy compounds Alkyl aryl ethers Pyridines and derivatives Pyrrolidine-2-ones Pyrrolidine-3-ones Vinylogous acids Tertiary carboxylic acid amides Thiazoles Heteroaromatic compounds Pyrroles Lactams Cyclic ketones Enols Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Pyridine - Pyrrolidone - 2-pyrrolidone - Benzenoid - 3-pyrrolidone - Azole - Heteroaromatic compound - Pyrrole - Vinylogous acid - Tertiary carboxylic acid amide - Thiazole - Lactam - Ketone - Cyclic ketone - Carboxamide group - Ether - Enol - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - 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