Compound Identification
SMILES
CCC1=CC2=C(C=C1)N=C(S2)N1C(C(=C(O)C2=CC=C(C)C=C2)C(=O)C1=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=CBDCJVVXSAZZKH-UHFFFAOYSA-N
Formula
C28H24N2O3S
Mass
468.57
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
Benzothiazoles Toluenes Pyrrolidine-2-ones Pyrrolidine-3-ones Vinylogous acids Heteroaromatic compounds Pyrroles Thiazoles Tertiary carboxylic acid amides Lactams Cyclic ketones Enols Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - 1,3-benzothiazole - Toluene - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Benzenoid - Heteroaromatic compound - Thiazole - Tertiary carboxylic acid amide - Vinylogous acid - Azole - Pyrrole - Cyclic ketone - Carboxamide group - Lactam - Ketone - Azacycle - Carboxylic acid derivative - Enol - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - 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