Compound Identification
SMILES
COC1=CC=C(C=C1)C1N(C(=O)C(O)=C1C(=O)C1=CC2=CC=CC=C2O1)C1=NN=C(SCC2=CC=C(Cl)C=C2)S1
InChIKey
InChIKey=XPJGTWWCAXLGHC-UHFFFAOYSA-N
Formula
C29H20ClN3O5S2
Mass
590.07
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 Anisoles Aryl ketones Methoxybenzenes Phenoxy compounds Pyrroline carboxylic acids and derivatives Alkylarylthioethers Chlorobenzenes Alkyl aryl ethers Aryl chlorides Thiadiazoles Tertiary carboxylic acid amides Pyrroles Vinylogous acids Furans Heteroaromatic compounds Lactams Enols Oxacyclic compounds Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Benzofuran - Anisole - Phenoxy compound - Aryl thioether - Phenol ether - Pyrroline carboxylic acid or derivatives - Aryl ketone - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Aryl halide - Furan - Thiadiazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Pyrrole - Azole - Vinylogous acid - Carboxamide group - Ketone - Lactam - Ether - Enol - Carboxylic acid derivative - Sulfenyl compound - Thioether - Azacycle - Oxacycle - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - 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