Compound Identification
SMILES
CCOC1=CC=C(C=C1)N1C(=O)C2SC3=C(SC(=S)N3)C(C2C1=O)C1=C(O)C=CC(=C1)[N+]([O-])=O
InChIKey
InChIKey=SICVVHNLIJEGHR-UHFFFAOYSA-N
Formula
C22H17N3O6S3
Mass
515.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
Nitrophenols Nitrobenzenes Nitroaromatic compounds Phenol ethers Phenoxy compounds Alkylarylthioethers Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Pyrrolidine-2-ones N-substituted carboxylic acid imides Thiopyrans Pyrroles Dicarboximides Heteroaromatic compounds Thiazoles Lactams Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organic zwitterions Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organic salts Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Nitrophenol - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Phenol ether - Phenoxy compound - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Alkylarylthioether - Pyrrolidone - Monocyclic benzene moiety - Benzenoid - 2-pyrrolidone - Thiopyran - Carboxylic acid imide, n-substituted - Pyrrole - Azole - Thiazole - Dicarboximide - Heteroaromatic compound - Carboxylic acid imide - Lactam - Organic nitro compound - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Organic 1,3-dipolar compound - Azacycle - Ether - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organic zwitterion - 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