Compound Identification
SMILES
[O-][N+](=O)C1=CC=CC(=C1)C1=NN=C(O1)SCC(=O)NC1=CC=C(C=C1)N1CCCC1
InChIKey
InChIKey=ZIEIIRYVBRXWKW-UHFFFAOYSA-N
Formula
C20H19N5O4S
Mass
425.46
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
Anilides Nitrobenzenes Aniline and substituted anilines Dialkylarylamines Nitroaromatic compounds N-arylamides Alkylarylthioethers 1,3,4-oxadiazoles Pyrroles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Organic zwitterions Carbonyl compounds Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Nitrobenzene - Anilide - Tertiary aliphatic/aromatic amine - Aryl thioether - Nitroaromatic compound - N-arylamide - Dialkylarylamine - Aniline or substituted anilines - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - 1,3,4-oxadiazole - Azole - Pyrrole - Heteroaromatic compound - Oxadiazole - Amino acid or derivatives - Secondary carboxylic acid amide - Tertiary amine - Carboxamide group - C-nitro compound - Organic nitro compound - Oxacycle - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Thioether - Organic salt - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic zwitterion - Organic nitrogen compound - Amine - 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