Compound Identification
SMILES
COC(=O)C1=C(C(=O)OC)C2=S(SC3=C2CCCC3)S1
InChIKey
InChIKey=NPBAUDWWHFWMNR-UHFFFAOYSA-N
Formula
C13H14O4S3
Mass
330.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class 6-Thiathiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
6-Thiathiophenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
6-Thiathiophenes
Alternative Parents
Dicarboxylic acids and derivatives Methyl esters Enoate esters Thioketones Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
6-thiathiophene - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Thioketone - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 6-thiathiophenes. These are aromatic heterocyclic compounds containing a 6-thiathiophene ring system, an analog of thieno[2,3-b]thiophene, with three adjacent sulfur atoms.
External Descriptors
Not available