Compound Identification
SMILES
CCCCOC1=CC=C(C=C1)C1N(C2=NN=C(C)S2)C(=O)C(=O)C1=C(O)C1=C(C)N=C2C=CC=CN12
InChIKey
InChIKey=LMLDKHHBVBQGHU-UHFFFAOYSA-N
Formula
C26H25N5O4S
Mass
503.58
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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
Imidazo[1,2-a]pyridines Imidazopyridines Phenol ethers Phenoxy compounds Alkyl aryl ethers Pyrrolidine-2-ones Pyridines and derivatives N-substituted imidazoles Pyrrolidine-3-ones Pyrroles Heteroaromatic compounds Thiadiazoles Vinylogous acids Tertiary carboxylic acid amides Lactams Cyclic ketones Enols Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Imidazo[1,2-a]pyridine - Imidazopyridine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - N-substituted imidazole - Pyridine - Benzenoid - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Azole - Imidazole - Heteroaromatic compound - Vinylogous acid - Pyrrole - Thiadiazole - Tertiary carboxylic acid amide - Lactam - Ketone - Cyclic ketone - Carboxamide group - Ether - Enol - Azacycle - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - 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