Compound Identification
SMILES
CCOC1=CC=CC(=C1)C1N(C(=O)C(O)=C1C(=O)C1=CC=C(C)O1)C1=NN=C(SCC2=CC=C(C)C=C2)S1
InChIKey
InChIKey=XELTUSLDUNDEEA-UHFFFAOYSA-N
Formula
C28H25N3O5S2
Mass
547.64
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolines
- Subclass Phenylpyrrolines
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Class
Pyrrolines
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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 Toluenes Alkylarylthioethers Vinylogous acids Thiadiazoles Tertiary carboxylic acid amides Furans Heteroaromatic compounds Pyrroles Lactams Enols Oxacyclic compounds Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrroline - Phenoxy compound - Aryl thioether - Phenol ether - Pyrroline carboxylic acid or derivatives - Aryl ketone - Alkyl aryl ether - Toluene - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Azole - Furan - Pyrrole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiadiazole - Vinylogous acid - Carboxamide group - Lactam - Ketone - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Oxacycle - Thioether - Enol - Ether - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - 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