Compound Identification
SMILES
OC1=C(C(N(C2=NC3=C(S2)C=C(F)C=C3)C1=O)C1=CC=C(Br)C=C1)C(=O)C1=CC2=CC=CC=C2O1
InChIKey
InChIKey=MDMJJTWSUICGFS-UHFFFAOYSA-N
Formula
C26H14BrFN2O4S
Mass
549.37
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 Bromobenzenes Aryl bromides Aryl fluorides Vinylogous acids Thiazoles Tertiary carboxylic acid amides Pyrroles Furans Heteroaromatic compounds Lactams Enols Oxacyclic compounds Azacyclic compounds Organic oxides Organobromides Organofluorides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - 1,3-benzothiazole - Benzofuran - Pyrroline carboxylic acid or derivatives - Aryl ketone - Bromobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Pyrrole - Tertiary carboxylic acid amide - Thiazole - Azole - Furan - Vinylogous acid - Ketone - Lactam - Carboxamide group - Azacycle - Carboxylic acid derivative - Enol - Oxacycle - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organobromide - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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