Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C2=C(C=C1)C1SC(C)(C)C(N1C2=O)C(=O)NCCCN1CCOCC1

InChIKey

InChIKey=ZOTBCWGYVUOQSL-UHFFFAOYSA-N

Formula

C22H31N3O5S

Mass

449.57

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

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 Morpholines Thiazolidines Tertiary carboxylic acid amides Trialkylamines Secondary carboxylic acid amides Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Dialkylthioethers Carbonyl compounds Hydrocarbon derivatives Organic oxides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid or derivatives - Isoindolone - Isoindole - Anisole - Phenol ether - Alkyl aryl ether - Morpholine - Oxazinane - Benzenoid - Tertiary carboxylic acid amide - Thiazolidine - Lactam - Tertiary amine - Secondary carboxylic acid amide - Tertiary aliphatic amine - Carboxamide group - Amino acid or derivatives - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Dialkylthioether - Thioether - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Carbonyl group - 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

Previous Back Next