Compound Identification
SMILES
CC1=CC2=C(C=C1)N=C(S2)C1=CC=C(C=C1)N1C(=O)CC(NCC2CCCO2)C1=O
InChIKey
InChIKey=SEPASKNGNXZLBB-UHFFFAOYSA-N
Formula
C23H23N3O3S
Mass
421.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Alpha amino acids and derivatives Benzothiazoles Pyrrolidine-2-ones N-substituted carboxylic acid imides Benzene and substituted derivatives Thiazoles Pyrroles Oxolanes Heteroaromatic compounds Dicarboximides Lactams Oxacyclic compounds Azacyclic compounds Dialkylamines Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Alpha-amino acid or derivatives - 1,3-benzothiazole - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Benzenoid - Oxolane - Azole - Thiazole - Dicarboximide - Carboxylic acid imide - Heteroaromatic compound - Pyrrole - Lactam - Amino acid or derivatives - Oxacycle - Carboxylic acid derivative - Azacycle - Dialkyl ether - Secondary aliphatic amine - Secondary amine - Ether - Amine - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - 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