Structure Information
Structure

Compound Identification

SMILES

CCOC1=CC=CC2=C1OC(=O)C(=C2)C1=CSC(NC(=O)CCC(=O)NC2CCCC2)=N1

InChIKey

InChIKey=COZWTJPIZZVEET-UHFFFAOYSA-N

Formula

C23H25N3O5S

Mass

455.53

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Coumarins and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Coumarin - Benzopyran - 1-benzopyran - Phenol ether - N-arylamide - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Pyranone - Fatty acyl - Benzenoid - Fatty amide - Pyran - N-acyl-amine - Heteroaromatic compound - Azole - Thiazole - Carboxamide group - Secondary carboxylic acid amide - Lactone - Organoheterocyclic compound - Azacycle - Ether - Carboxylic acid derivative - Oxacycle - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).

External Descriptors

Not available

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