Compound Identification
SMILES
CCOC(=O)C(C#N)=C1SSC(S1)=C(C#N)C(=O)OCC
InChIKey
InChIKey=BJEFMLAPLDTDNB-UHFFFAOYSA-N
Formula
C12H10N2O4S3
Mass
342.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Dicarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Dicarboxylic acids and derivatives
Alternative Parents
Vinylogous thioesters Trithiolanes Enoate esters Organic disulfides Ketene acetals Nitriles Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Dicarboxylic acid or derivatives - Vinylogous thioester - Trithiolane - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Ketene acetal or derivatives - Organic disulfide - Carbonitrile - Nitrile - Organoheterocyclic compound - Organonitrogen compound - Organic oxide - Carbonyl group - Cyanide - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups.
External Descriptors
Not available