Compound Identification
SMILES
CC1=CC(C)=C2N=C(SC2=C1)N1[C@H](C(C(=O)C2=CC3=CC=CC=C3O2)=C(O)C1=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=DGRZIWPPEZJVEX-DEOSSOPVSA-N
Formula
C28H19ClN2O4S
Mass
514.98
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 Aryl ketones Pyrroline carboxylic acids and derivatives Chlorobenzenes Aryl chlorides Vinylogous acids Thiazoles Tertiary carboxylic acid amides Pyrroles Furans Heteroaromatic compounds Lactams Azacyclic compounds Enols Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Benzofuran - 1,3-benzothiazole - Aryl ketone - Pyrroline carboxylic acid or derivatives - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Thiazole - Pyrrole - Vinylogous acid - Heteroaromatic compound - Furan - Azole - Carboxamide group - Ketone - Lactam - Enol - Carboxylic acid derivative - Azacycle - Oxacycle - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organohalogen 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