Structure Information
Structure

Compound Identification

SMILES

CC1=CC=CC=C1CN1C2=C(SC3=CC=CC=C3C1=O)C=CC(=C2)C(=O)NCCC1=CC=C(Cl)C=C1

InChIKey

InChIKey=NVBKPAFCSGFBGF-UHFFFAOYSA-N

Formula

C30H25ClN2O2S

Mass

513.05

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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 Toluenes Chlorobenzenes Vinylogous thioesters Aryl chlorides Tertiary carboxylic acid amides Secondary carboxylic acid amides Lactams Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dibenzothiazepine - Diarylthioether - Aryl thioether - Chlorobenzene - Halobenzene - Toluene - Vinylogous thioester - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl chloride - Tertiary carboxylic acid amide - Carboxamide group - Secondary carboxylic acid amide - Lactam - Azacycle - Thioether - Carboxylic acid derivative - Organooxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - 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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