Compound Identification
SMILES
COC1=C(OC)C2=C(C=C1)C1SCC(N1C2=O)C(=O)NCCC1=CC=C(Cl)C=C1
InChIKey
InChIKey=KDUNUTQGXGGGGU-UHFFFAOYSA-N
Formula
C21H21ClN2O4S
Mass
432.92
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoindoles and derivatives
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Subclass
Isoindolines
- Level 5 Isoindolones
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Subclass
Isoindolines
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Class
Isoindoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoindoles and derivatives
Subclass
Isoindolines
Intermediate Tree Nodes
Not available
Direct Parent
Isoindolones
Alternative Parents
Alpha amino acids and derivatives Isoindoles Anisoles Alkyl aryl ethers Chlorobenzenes Aryl chlorides Thiazolidines Tertiary carboxylic acid amides Secondary carboxylic acid amides Lactams Dialkylthioethers Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Isoindolone - Isoindole - Anisole - Phenol ether - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Thiazolidine - Lactam - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Dialkylthioether - Thioether - Carboxylic acid derivative - Ether - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoindolones. These are aromatic polycyclic compounds that an isoindole bearing a ketone.
External Descriptors
Not available