Compound Identification
SMILES
COC(=O)C[C@H]1CCn2c1c(Sc1ccc(Cl)cc1)c1c(Br)ccc(F)c21
InChIKey
InChIKey=OQDBAGLSFPGEQN-LLVKDONJSA-N
Formula
C20H16BrClFNO2S
Mass
468.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
-
Class
Thioethers
-
Subclass
Aryl thioethers
- Level 5 Diarylthioethers
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Subclass
Aryl thioethers
-
Class
Thioethers
-
Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Thioethers
Subclass
Aryl thioethers
Intermediate Tree Nodes
Not available
Direct Parent
Diarylthioethers
Alternative Parents
Indoles Thiophenol ethers Pyrrolizines Chlorobenzenes Aryl bromides Substituted pyrroles Aryl chlorides Aryl fluorides Heteroaromatic compounds Methyl esters Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Organobromides Organochlorides Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diarylthioether - Indole or derivatives - Indole - Pyrrolizine - Thiophenol ether - Halobenzene - Chlorobenzene - Aryl bromide - Aryl chloride - Aryl fluoride - Monocyclic benzene moiety - Benzenoid - Aryl halide - Substituted pyrrole - Methyl ester - Pyrrole - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Sulfenyl compound - Organofluoride - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organobromide - Carbonyl group - Organochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen 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