Structure Information
Structure

Compound Identification

SMILES

CS(O)(=O)=O.CS(O)(=O)=O.CN1CCN(CC1)C1CC2=C(SC3=CC=CC=C13)C=CC(NC(C)=O)=C2

InChIKey

InChIKey=JHEZFECQOHVUPL-UHFFFAOYSA-N

Formula

C23H33N3O7S3

Mass

559.71

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiepins

Subclass

Dibenzothiepins

Intermediate Tree Nodes

Not available

Direct Parent

Dibenzothiepins

Alternative Parents

Diarylthioethers N-acetylarylamines N-methylpiperazines Aralkylamines Benzenoids Sulfonyls Organosulfonic acids Acetamides Methanesulfonates Alkanesulfonic acids Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides

Molecular Framework

Not available

Substituents

Dibenzothiepin - Diarylthioether - N-acetylarylamine - Aryl thioether - N-arylamide - N-methylpiperazine - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Piperazine - Benzenoid - Acetamide - Organic sulfonic acid or derivatives - Alkanesulfonic acid - Methanesulfonate - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Azacycle - Thioether - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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