Compound Identification
SMILES
OC(=O)CCCSC1=NC2=C(CC(CC2)C(O)=O)S1
InChIKey
InChIKey=ICGNPTVSZFQWTP-UHFFFAOYSA-N
Formula
C12H15NO4S2
Mass
301.38
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
Thia fatty acids Alkylarylthioethers Dicarboxylic acids and derivatives Thiazoles Heteroaromatic compounds Sulfenyl compounds Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl thioether - Thia fatty acid - Alkylarylthioether - Dicarboxylic acid or derivatives - Fatty acyl - Azole - Thiazole - Heteroaromatic compound - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Aromatic heteropolycyclic 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