Structure Information
Structure

Compound Identification

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.CN(C)CCCSC1CC2=CC=CC=C2SC2=C1C=C(Cl)C=C2

InChIKey

InChIKey=RSQIONOQBFEBKD-UHFFFAOYSA-N

Formula

C25H30ClNO7S2

Mass

556.09

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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

Molecular Framework

Not available

Substituents

Dibenzothiepin - Diarylthioether - Tricarboxylic acid or derivatives - Aryl thioether - Alpha-hydroxy acid - Aryl chloride - Aryl halide - Hydroxy acid - Benzenoid - Tertiary alcohol - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Dialkylthioether - Sulfenyl compound - Thioether - Organochloride - Organohalogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - 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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