Compound Identification
SMILES
CC1=CC=C(C=C1)N1C(=O)C(=O)\C(=C(/NCCN\C(=C2\C(=S)N(C(=O)C2=O)C2=CC=C(C)C=C2)C2=CC=CC=C2)C2=CC=CC=C2)C1=S
InChIKey
InChIKey=WJQUXOWOKSNLSA-JWTBXLROSA-N
Formula
C38H30N4O4S2
Mass
670.8
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
Toluenes Pyrrolidine-3-ones Pyrrolidine-2-ones Vinylogous amides Thiolactams Pyrroles Lactams Cyclic ketones Amino acids and derivatives Enamines Dialkylamines Azacyclic compounds Thiocarbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Toluene - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Benzenoid - 3-pyrrolidone - Pyrrole - Vinylogous amide - Thiolactam - Amino acid or derivatives - Ketone - Lactam - Cyclic ketone - Enamine - Secondary aliphatic amine - Carboxylic acid derivative - Azacycle - Secondary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Carbonyl group - Organic nitrogen compound - Thiocarbonyl 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