Compound Identification
SMILES
CC1=CC=C(CSC2=NN=C(S2)N2[C@@H](C(C(=O)C3=CC4=CC=CC=C4O3)=C(O)C2=O)C2=CC=CC=C2F)C=C1
InChIKey
InChIKey=YYJHFDVMNJONQW-XMMPIXPASA-N
Formula
C29H20FN3O4S2
Mass
557.61
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 Pyrroline carboxylic acids and derivatives Aryl ketones Toluenes Alkylarylthioethers Fluorobenzenes Aryl fluorides Vinylogous acids Thiadiazoles Tertiary carboxylic acid amides Pyrroles Furans Heteroaromatic compounds Lactams Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Enols Organofluorides Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Benzofuran - Aryl thioether - Pyrroline carboxylic acid or derivatives - Aryl ketone - Fluorobenzene - Halobenzene - Toluene - Alkylarylthioether - Aryl fluoride - Monocyclic benzene moiety - Benzenoid - Aryl halide - Furan - Azole - Heteroaromatic compound - Vinylogous acid - Pyrrole - Tertiary carboxylic acid amide - Thiadiazole - Lactam - Ketone - Carboxamide group - Azacycle - Enol - Oxacycle - Carboxylic acid derivative - Thioether - Sulfenyl compound - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen 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