Compound Identification
SMILES
CC1=CC=C(C=C1)C1=NN([C@H](C1)C1=CC=C(Cl)C=C1)C(=N)S[C@@H]1CC(=O)N(C1=O)C1=CC(Cl)=CC=C1
InChIKey
InChIKey=NQEZKQWMOBAWEB-DNQXCXABSA-N
Formula
C27H22Cl2N4O2S
Mass
537.46
Taxonomic Classification
Taxonomy Tree
-
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
Toluenes Chlorobenzenes Aryl chlorides Pyrrolidine-2-ones N-substituted carboxylic acid imides Pyrroles Dicarboximides Pyrazolines Lactams Azacyclic compounds Sulfenyl compounds Imines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Chlorobenzene - Halobenzene - Toluene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - Benzenoid - Pyrazoline - Carboxylic acid imide - Pyrrole - Dicarboximide - Lactam - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Organic oxide - Imine - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur 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