Compound Identification
SMILES
CCOC1=CC=C(C=C1)C1=NN=C(O1)SCC(=O)NC1=C(C=CC(Cl)=C1)N1CCCC1
InChIKey
InChIKey=SHSSVHVIXYAQPG-UHFFFAOYSA-N
Formula
C22H23ClN4O3S
Mass
458.96
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
2'-Aminoanilides Phenoxy compounds Phenol ethers Aniline and substituted anilines N-arylamides Dialkylarylamines Alkyl aryl ethers Alkylarylthioethers Chlorobenzenes Aryl chlorides 1,3,4-oxadiazoles Pyrroles Heteroaromatic compounds Amino acids and derivatives Secondary carboxylic acid amides Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Carbonyl compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - 2'-aminoanilide - Anilide - Phenol ether - Tertiary aliphatic/aromatic amine - N-arylamide - Dialkylarylamine - Aniline or substituted anilines - Phenoxy compound - Aryl thioether - Chlorobenzene - Halobenzene - Alkyl aryl ether - Alkylarylthioether - Aryl halide - Monocyclic benzene moiety - Aryl chloride - Benzenoid - Pyrrole - Heteroaromatic compound - 1,3,4-oxadiazole - Oxadiazole - Azole - Tertiary amine - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Sulfenyl compound - Thioether - Oxacycle - Azacycle - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organosulfur compound - Amine - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - 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