Structure Information
Structure

Compound Identification

SMILES

FC1=CC=CC(CN2C3=C(SC4=CC=CC=C4C2=O)C=CC(=C3)C(=O)NCC[NH+]2CCOCC2)=C1

InChIKey

InChIKey=XZYAZKFQCIFSJF-UHFFFAOYSA-O

Formula

C27H27FN3O3S

Mass

492.59

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiazepines

Subclass

Dibenzothiazepines

Intermediate Tree Nodes

Not available

Direct Parent

Dibenzothiazepines

Alternative Parents

Diarylthioethers Fluorobenzenes Vinylogous thioesters Aryl fluorides Morpholines Tertiary carboxylic acid amides Quaternary ammonium salts Trialkylamines Lactams Secondary carboxylic acid amides Amino acids and derivatives Dialkyl ethers Azacyclic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives Organofluorides Organic cations

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dibenzothiazepine - Diarylthioether - Aryl thioether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - Vinylogous thioester - Tertiary carboxylic acid amide - Quaternary ammonium salt - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Lactam - Thioether - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Amine - Organohalogen compound - Hydrocarbon derivative - Organofluoride - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dibenzothiazepines. These are compounds containing a dibenzothiazepine moiety, which consists of two benzene connected by a thiazepine ring.

External Descriptors

Not available

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