Structure Information
Structure

Compound Identification

SMILES

FC1=CC=CC=C1CN1C2=C(SC3=CC=CC=C3C1=O)C=CC(=C2)C(=O)N1CCN(CC2=CC3=C(OCO3)C=C2)CC1

InChIKey

InChIKey=VZKKGJAUHJVLAO-UHFFFAOYSA-N

Formula

C33H28FN3O4S

Mass

581.66

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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 Benzodioxoles Aralkylamines N-alkylpiperazines Fluorobenzenes Vinylogous thioesters Aryl fluorides Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Lactams Acetals Oxacyclic compounds Azacyclic compounds Organofluorides Organopnictogen compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dibenzothiazepine - Diarylthioether - Benzodioxole - Aryl thioether - Halobenzene - Fluorobenzene - N-alkylpiperazine - Aralkylamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Piperazine - Benzenoid - 1,4-diazinane - Vinylogous thioester - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Lactam - Tertiary amine - Carboxamide group - Amino acid or derivatives - Acetal - Oxacycle - Carboxylic acid derivative - Azacycle - Thioether - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - 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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