Structure Information
Structure

Compound Identification

SMILES

[Na+].CCOC(CC1=CC2=C(C=C1)C=C(OCCN1CCSC3=CC=CC=C13)C=C2)C([O-])=O

InChIKey

InChIKey=CDQMTLGERMWLRW-UHFFFAOYSA-M

Formula

C25H26NNaO4S

Mass

459.54

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiazines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzothiazines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzothiazine - Naphthalene - Aryl thioether - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Alkyl aryl ether - Alkylarylthioether - Para-thiazine - Benzenoid - Amino acid or derivatives - Carboxylic acid salt - Amino acid - Tertiary amine - Thioether - Organic alkali metal salt - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organic salt - Amine - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic zwitterion - Organic nitrogen compound - Organic sodium salt - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzothiazines. These are organic compounds containing a benzene fused to a thiazine ring (a six-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).

External Descriptors

Not available

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