Compound Identification
SMILES
OC1=C(C(N(C2=NC3=C(S2)C=C(F)C=C3)C1=O)C1=CC=C(I)C=C1)C(=O)C1=CC2=CC=CC=C2O1
InChIKey
InChIKey=XPBIYZSNRBGSIF-UHFFFAOYSA-N
Formula
C26H14FIN2O4S
Mass
596.37
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 Benzothiazoles Pyrroline carboxylic acids and derivatives Aryl ketones Iodobenzenes Aryl fluorides Aryl iodides Vinylogous acids Thiazoles Tertiary carboxylic acid amides Pyrroles Furans Heteroaromatic compounds Lactams Oxacyclic compounds Enols Azacyclic compounds Organic oxides Organofluorides Organoiodides Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Benzofuran - 1,3-benzothiazole - Aryl ketone - Pyrroline carboxylic acid or derivatives - Iodobenzene - Halobenzene - Aryl fluoride - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Thiazole - Pyrrole - Vinylogous acid - Furan - Heteroaromatic compound - Azole - Carboxamide group - Ketone - Lactam - Enol - Carboxylic acid derivative - Azacycle - Oxacycle - Organic nitrogen compound - Organoiodide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organohalogen compound - Organofluoride - 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