Compound Identification
SMILES
CCCCCOC1=CC=C(C=C1)C1N(C(=O)C(O)=C1C(=O)C1=CC2=CC=CC=C2O1)C1=NN=C(SCC2=CC=CC=C2Cl)S1
InChIKey
InChIKey=PWBIHXULNGABPN-UHFFFAOYSA-N
Formula
C33H28ClN3O5S2
Mass
646.17
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
Benzofurans Aryl ketones Pyrroline carboxylic acids and derivatives Phenoxy compounds Phenol ethers Alkyl aryl ethers Alkylarylthioethers Chlorobenzenes Aryl chlorides Vinylogous acids Thiadiazoles Tertiary carboxylic acid amides Pyrroles Furans Heteroaromatic compounds Lactams Azacyclic compounds Enols Oxacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Benzofuran - Phenoxy compound - Aryl thioether - Phenol ether - Pyrroline carboxylic acid or derivatives - Aryl ketone - Alkyl aryl ether - Chlorobenzene - Halobenzene - Alkylarylthioether - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl chloride - Heteroaromatic compound - Vinylogous acid - Thiadiazole - Tertiary carboxylic acid amide - Azole - Pyrrole - Furan - Carboxamide group - Ketone - Lactam - Thioether - Sulfenyl compound - Azacycle - Oxacycle - Carboxylic acid derivative - Ether - Enol - Organooxygen compound - Organic oxygen compound - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic 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