Structure Information
Structure

Compound Identification

SMILES

O=C1OC2=C(C=CC(OCC3=CC(=O)N4C=CSC4=N3)=C2)C2=C1CCCCC2

InChIKey

InChIKey=FJADCBJNCODIHL-UHFFFAOYSA-N

Formula

C21H18N2O4S

Mass

394.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Cycloheptapyrans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Cycloheptapyrans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Coumarin - Cycloheptapyran - Benzopyran - 1-benzopyran - Phenol ether - Alkyl aryl ether - Pyrimidone - Pyranone - Benzenoid - Pyrimidine - Pyran - Azole - Heteroaromatic compound - Thiazole - Lactam - Lactone - Oxacycle - Ether - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cycloheptapyrans. These are organic heterocyclic compounds containing a cycloheptane derivative fused to a pyran. Pyran a six-membered heterocyclic, non-aromatic ring, made up of five carbon atoms and one oxygen atom and containing two double bonds.

External Descriptors

Not available

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