Compound Identification
SMILES
COC1=CC=C(C=C1)C(\C)=N/[NH+]=C(N)S[C@H]1CC(=O)N(C1=O)C1=CC=CC=C1
InChIKey
InChIKey=CWWPPHYHFZSTSA-RIWZNOJBSA-O
Formula
C20H21N4O3S
Mass
397.47
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
Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers S-alkylisothiosemicarbazones Thiosemicarbazones Pyrrolidine-2-ones N-substituted carboxylic acid imides Pyrroles Dicarboximides Lactams Sulfenyl compounds Carboximidamides Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - S-alkylisothiosemicarbazone - Isothiosemicarbazone - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - Pyrrolidone - 2-pyrrolidone - Thiosemicarbazone - Carboxylic acid imide - Dicarboximide - Pyrrole - Lactam - Azacycle - Ether - Carboxylic acid derivative - Sulfenyl compound - Carboximidamide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic cation - 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