Compound Identification
SMILES
ClC1=CC2=C(OC(SCC(=O)NC3=C(N4CCCC4)C(Cl)=CC=C3)=N2)C=C1
InChIKey
InChIKey=YFEQSOBSAAICNY-UHFFFAOYSA-N
Formula
C19H17Cl2N3O2S
Mass
422.32
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 Benzoxazoles Aniline and substituted anilines N-arylamides Dialkylarylamines Alkylarylthioethers Chlorobenzenes Aryl chlorides Pyrroles Oxazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - 2'-aminoanilide - Benzoxazole - Anilide - Aryl thioether - Aniline or substituted anilines - Dialkylarylamine - N-arylamide - Tertiary aliphatic/aromatic amine - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Oxazole - Pyrrole - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Thioether - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Oxacycle - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organooxygen compound - Organosulfur 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