Compound Identification
SMILES
COC1=C(O)C(Br)=CC(=C1)C1N(C(=O)C(=O)C1=C(O)C1=CC(F)=C(C)C=C1)C1=NN=C(SCC2=CC=CC3=CC=CC=C23)S1
InChIKey
InChIKey=SNDKQHWLBXJXFS-UHFFFAOYSA-N
Formula
C32H23BrFN3O5S2
Mass
692.57
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
Methoxyphenols Naphthalenes Anisoles Phenoxy compounds Methoxybenzenes O-bromophenols Alkyl aryl ethers Toluenes Alkylarylthioethers Bromobenzenes Fluorobenzenes Aryl bromides Pyrrolidine-3-ones Pyrrolidine-2-ones Aryl fluorides Vinylogous acids Thiadiazoles Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Cyclic ketones Lactams Enols Azacyclic compounds Sulfenyl compounds Organofluorides Organonitrogen compounds Hydrocarbon derivatives Organobromides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Naphthalene - Methoxyphenol - Phenol ether - 2-halophenol - 2-bromophenol - Phenoxy compound - Methoxybenzene - Aryl thioether - Anisole - Alkylarylthioether - Alkyl aryl ether - Phenol - Toluene - Halobenzene - Fluorobenzene - Bromobenzene - Benzenoid - Monocyclic benzene moiety - Pyrrolidone - Aryl halide - 2-pyrrolidone - Aryl fluoride - Aryl bromide - 3-pyrrolidone - Heteroaromatic compound - Vinylogous acid - Azole - Thiadiazole - Pyrrole - Tertiary carboxylic acid amide - Cyclic ketone - Ketone - Carboxamide group - Lactam - Azacycle - Sulfenyl compound - Thioether - Carboxylic acid derivative - Enol - Ether - Organic oxide - Organooxygen compound - Carbonyl group - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - 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