Compound Identification
SMILES
CCCCOC1=CC=CC(=C1)[C@@H]1N(C(=O)C(O)=C1C(=O)C1=CC=C(C)O1)C1=NC=CS1
InChIKey
InChIKey=WSCAKRWHDMLFCI-IBGZPJMESA-N
Formula
C23H22N2O5S
Mass
438.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyrrolines
- Subclass Phenylpyrrolines
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Class
Pyrrolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolines
Subclass
Phenylpyrrolines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolines
Alternative Parents
Aryl ketones Phenol ethers Pyrroline carboxylic acids and derivatives Phenoxy compounds Alkyl aryl ethers Vinylogous acids Thiazoles Furans Heteroaromatic compounds Tertiary carboxylic acid amides Pyrroles Lactams Oxacyclic compounds Azacyclic compounds Enols Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrroline - Phenoxy compound - Phenol ether - Pyrroline carboxylic acid or derivatives - Aryl ketone - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Azole - Furan - Pyrrole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Vinylogous acid - Lactam - Ketone - Carboxamide group - Ether - Enol - Oxacycle - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrroline ring through a CC or CN bond.
External Descriptors
Not available