Compound Identification
SMILES
COC1=CC([C@@H]2CCC[NH+]2CC2=CC(=O)N3C=CSC3=N2)=C(OC)C=C1
InChIKey
InChIKey=STCKDTXLHSYGQR-INIZCTEOSA-O
Formula
C19H22N3O3S
Mass
372.46
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
Dimethoxybenzenes Anisoles Phenoxy compounds Alkyl aryl ethers Aralkylamines Pyrimidones N-alkylpyrrolidines Heteroaromatic compounds Thiazoles Quaternary ammonium salts Pyrroles Lactams Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - P-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyrimidone - Aralkylamine - Pyrimidine - N-alkylpyrrolidine - Monocyclic benzene moiety - Benzenoid - Pyrrole - Quaternary ammonium salt - Azole - Thiazole - Heteroaromatic compound - Lactam - Tertiary aliphatic amine - Tertiary amine - Azacycle - Ether - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - 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