Compound Identification
SMILES
CCOC1=CC=CC(=C1)C1N(C(=O)C(O)=C1C(=O)C1=CC=C(C)O1)C1=NN=C(SCC2=CC=CC=C2Cl)S1
InChIKey
InChIKey=QDJMMTDBKXCZSJ-UHFFFAOYSA-N
Formula
C27H22ClN3O5S2
Mass
568.06
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 Phenoxy compounds Pyrroline carboxylic acids and derivatives Alkyl aryl ethers Alkylarylthioethers Chlorobenzenes Aryl chlorides Thiadiazoles Heteroaromatic compounds Furans Vinylogous acids Tertiary carboxylic acid amides Pyrroles Lactams Oxacyclic compounds Enols Azacyclic compounds Sulfenyl compounds Organonitrogen compounds Organochlorides 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 - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl halide - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Furan - Heteroaromatic compound - Azole - Vinylogous acid - Pyrrole - Tertiary carboxylic acid amide - Thiadiazole - Carboxamide group - Ketone - Lactam - Ether - Sulfenyl compound - Azacycle - Oxacycle - Enol - Carboxylic acid derivative - Thioether - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - 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