Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C1CCCN1C(=S)NC1=C(C)C=CC=C1C
InChIKey
InChIKey=ZWDURCJHNUNHFH-UHFFFAOYSA-N
Formula
C21H26N2O2S
Mass
370.51
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
N-phenylthioureas Dimethoxybenzenes m-Xylenes Phenoxy compounds Anisoles Alkyl aryl ethers Pyrroles Thioureas Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - N-phenylthiourea - Dimethoxybenzene - O-dimethoxybenzene - Phenol ether - Phenoxy compound - Anisole - M-xylene - Methoxybenzene - Xylene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Pyrrole - Thiourea - Ether - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxygen 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