Compound Identification
SMILES
[O-]C1=C(C=C(C=C1)[N+]([O-])=O)[C@H]1[C@H]2[C@H](SC3=C1SC(=O)N3)C(=O)N(C2=O)C1=CC=CC=C1
InChIKey
InChIKey=CXJBOGIOWQBSGB-DZKIICNBSA-M
Formula
C20H12N3O6S2
Mass
454.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
-
Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Nitrobenzenes Nitroaromatic compounds Phenoxides Alkylarylthioethers Thiopyrans Pyrrolidine-2-ones N-substituted carboxylic acid imides Thiazoles Pyrroles Dicarboximides Heteroaromatic compounds Lactams Azacyclic compounds Organic oxoazanium compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic salts Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Phenoxide - Alkylarylthioether - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - Thiopyran - Benzenoid - Heteroaromatic compound - Carboxylic acid imide - Dicarboximide - Azole - Pyrrole - Thiazole - Organic nitro compound - Lactam - C-nitro compound - Carboxylic acid derivative - Thioether - Azacycle - Organic oxoazanium - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic salt - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic cation - 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