Structure Information
Structure

Compound Identification

SMILES

OC(=O)CCCCCCCCCCSC1=NC=NC2=C1N(CC1=CC3=C(SC4=NC=CN=C4N3)C=C1)C=N2

InChIKey

InChIKey=ZBJCORJJAPPSMQ-UHFFFAOYSA-N

Formula

C27H31N7O2S2

Mass

549.71

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organosulfur compounds

Class

Thioethers

Subclass

Aryl thioethers

Intermediate Tree Nodes

Not available

Direct Parent

Diarylthioethers

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Diarylthioether - Benzothiazine - 6-thiopurine - Imidazopyrimidine - Purine - Medium-chain fatty acid - Heterocyclic fatty acid - Alkylarylthioether - Para-thiazine - N-substituted imidazole - Pyrazine - Pyrimidine - Benzenoid - Fatty acyl - Imidolactam - Fatty acid - Azole - Heteroaromatic compound - Imidazole - Amino acid or derivatives - Amino acid - Secondary amine - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Amine - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as diarylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two aryl groups.

External Descriptors

Not available

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