Compound Identification
SMILES
COC(=O)C1=CC=CC=C1SC1=C(\C=N\OC(=O)C2CC2)C(=NN1C)C(F)(F)F
InChIKey
InChIKey=NSIQUJSWJOISLF-LSFURLLWSA-N
Formula
C18H16F3N3O4S
Mass
427.4
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
Benzoic acid esters O-sulfanylbenzoic acids and derivatives Thiophenol ethers Benzoyl derivatives Vinylogous thioesters Cyclopropanecarboxylic acids and derivatives Pyrazoles Oxime esters Heteroaromatic compounds Methyl esters Azacyclic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Carbonyl compounds Organofluorides Organic oxides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diarylthioether - O-sulfanylbenzoic acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Thiophenol ether - Cyclopropanecarboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - Vinylogous thioester - Azole - Methyl ester - Heteroaromatic compound - Pyrazole - Oximester - Carboxylic acid ester - Sulfenyl compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteromonocyclic 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