Compound Identification
SMILES
COC1=NC2=C(SC3=C2NC(=O)N(CCCCN2CC[C@](C)(C2)C2=CC=CC=C2OC)C3=O)C=C1
InChIKey
InChIKey=NWJRGHDNBYPUEN-AREMUKBSSA-N
Formula
C26H30N4O4S
Mass
494.61
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
-
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
Thienopyrimidines Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Aralkylamines Pyrimidones N-alkylpyrrolidines Pyridines and derivatives Vinylogous amides Heteroaromatic compounds Thiophenes Pyrroles Ureas Lactams Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrolidine - Thienopyrimidine - Anisole - Phenol ether - Phenoxy compound - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Pyrimidone - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Pyridine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Thiophene - Pyrrole - Lactam - Urea - Tertiary aliphatic amine - Tertiary amine - Ether - Azacycle - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - 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