Compound Identification
SMILES
Cl.CN(C)CCC(SC1=CC=C(C)C=C1)C([O-])=O
InChIKey
InChIKey=XEEXUXCXWAYTRU-UHFFFAOYSA-M
Formula
C13H19ClNO2S
Mass
288.81
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
-
Class
Thioethers
- Subclass Aryl thioethers
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Class
Thioethers
-
Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Thioethers
Subclass
Aryl thioethers
Intermediate Tree Nodes
Not available
Direct Parent
Aryl thioethers
Alternative Parents
Thiophenol ethers Alkylarylthioethers Toluenes Thia fatty acids Amino fatty acids Trialkylamines Amino acids Carboxylic acid salts Carboxylic acids Sulfenyl compounds Monocarboxylic acids and derivatives Hydrochlorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic anions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Aryl thioether - Thiophenol ether - Amino fatty acid - Thia fatty acid - Toluene - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Amino acid or derivatives - Amino acid - Tertiary aliphatic amine - Carboxylic acid salt - Tertiary amine - Carboxylic acid derivative - Sulfenyl compound - Carboxylic acid - Monocarboxylic acid or derivatives - Hydrochloride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Amine - Hydrocarbon derivative - Organic anion - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.
External Descriptors
Not available