Compound Identification
SMILES
CC1=C(C=CC(Br)=C1)N1C(=O)CC(SC2=CC=CC=C2N)C1=O
InChIKey
InChIKey=QQNZEWPFVMDFQI-UHFFFAOYSA-N
Formula
C17H15BrN2O2S
Mass
391.28
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
Thiophenol ethers Aniline and substituted anilines Toluenes Alkylarylthioethers Bromobenzenes Pyrrolidine-2-ones Aryl bromides N-substituted carboxylic acid imides Pyrroles Dicarboximides Amino acids and derivatives Lactams Sulfenyl compounds Azacyclic compounds Primary amines Organic oxides Organobromides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Aryl thioether - Thiophenol ether - Aniline or substituted anilines - Halobenzene - Toluene - Bromobenzene - Alkylarylthioether - Carboxylic acid imide, n-substituted - Aryl bromide - Pyrrolidone - 2-pyrrolidone - Aryl halide - Benzenoid - Monocyclic benzene moiety - Dicarboximide - Pyrrole - Carboxylic acid imide - Amino acid or derivatives - Lactam - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Thioether - Organosulfur compound - Primary amine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organohalogen compound - Organobromide - 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