Compound Identification
SMILES
C[C@H](CNC1=CC=NC(=O)\C1=C1/NC2=C(N1)C=C1C(CN(CCCN3CCCC3)C1=O)=C2)C1=CC=CS1
InChIKey
InChIKey=BRGUDNFOEXLWIE-IRCXXISZSA-N
Formula
C28H32N6O2S
Mass
516.66
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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
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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
Benzimidazoles Isoindoles Dihydropyridines Aralkylamines Benzenoids N-alkylpyrrolidines Vinylogous amides Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Amino acids and derivatives N-acylimines Lactams Ketene acetals Enamines Azacyclic compounds Dialkylamines Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoindolone - Benzimidazole - Isoindole - Dihydropyridine - Aralkylamine - N-alkylpyrrolidine - Benzenoid - Hydropyridine - Pyrrolidine - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Vinylogous amide - Tertiary aliphatic amine - Ketene acetal or derivatives - N-acylimine - Amino acid or derivatives - Carboxamide group - Tertiary amine - Lactam - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Amine - Organooxygen compound - Organonitrogen 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