Compound Identification
SMILES
CN1C=C(SC2=CC=CC=C2)C(C(O)=O)=C1C
InChIKey
InChIKey=YANKXEKCPMUQDL-UHFFFAOYSA-N
Formula
C13H13NO2S
Mass
247.31
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
Thiophenol ethers Pyrrole carboxylic acids Vinylogous thioesters N-methylpyrroles Benzene and substituted derivatives Vinylogous amides Heteroaromatic compounds Sulfenyl compounds Carboxylic acids Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diarylthioether - Pyrrole-3-carboxylic acid - Pyrrole-3-carboxylic acid or derivatives - Thiophenol ether - Monocyclic benzene moiety - N-methylpyrrole - Vinylogous thioester - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Pyrrole - Vinylogous amide - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - 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