Compound Identification
SMILES
CCCCCOC1=C(OCC)C=C(C=C1)C1N(C(=O)C(O)=C1C(=O)C1=CC=CS1)C1=NN=C(SCC2=CC=CC=C2)S1
InChIKey
InChIKey=MTKLZGZHUPEGIB-UHFFFAOYSA-N
Formula
C31H31N3O5S3
Mass
621.79
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
Pyrroline carboxylic acids and derivatives Phenoxy compounds Phenol ethers Aryl ketones Alkyl aryl ethers Alkylarylthioethers Vinylogous acids Thiophenes Thiadiazoles Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Lactams Sulfenyl compounds Azacyclic compounds Enols Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrroline - Phenol ether - Phenoxy compound - Aryl thioether - Pyrroline carboxylic acid or derivatives - Aryl ketone - Alkyl aryl ether - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Vinylogous acid - Heteroaromatic compound - Azole - Thiophene - Thiadiazole - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Ketone - Lactam - Azacycle - Sulfenyl compound - Thioether - Carboxylic acid derivative - Enol - Ether - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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