Compound Identification
SMILES
COC1=CC=CC=C1[C@@H]1CCN(CCCCN2C(=O)NC3=C(SC4=NC=C(Cl)C=C34)C2=O)C1
InChIKey
InChIKey=YUPRJQUQOPJAJW-OAHLLOKOSA-N
Formula
C24H25ClN4O3S
Mass
485.0
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
Thienopyrimidines Thienopyridines Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Aralkylamines Pyrimidones Aryl chlorides Pyridines and derivatives N-alkylpyrrolidines Vinylogous amides Thiophenes Heteroaromatic compounds Pyrroles Trialkylamines Lactams Ureas Azacyclic compounds Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrolidine - Thienopyridine - Thienopyrimidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyrimidone - Aralkylamine - Benzenoid - N-alkylpyrrolidine - Pyridine - Pyrimidine - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Heteroaromatic compound - Vinylogous amide - Thiophene - Pyrrole - Urea - Lactam - Tertiary aliphatic amine - Tertiary amine - Azacycle - Ether - Amine - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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