Compound Identification
SMILES
CCN1C(=S)N(CN2CCC[C@H]2C2=CC(C)=C(C)C=C2)N=C1C1=CC=NC=C1
InChIKey
InChIKey=FDDVDUQHVQLNSH-FQEVSTJZSA-N
Formula
C22H27N5S
Mass
393.55
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
Pyridyl-1,2,4-triazoles o-Xylenes N-alkylpyrrolidines Triazolines Triazoles Pyrroles Heteroaromatic compounds Azacyclic compounds Organosulfur compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Pyridyltriazole - Pyridyl-1,2,4-triazole - Xylene - O-xylene - Pyridine - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Triazoline - Heteroaromatic compound - Pyrrole - Triazole - 1,2,4-triazole - Azole - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - 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