Compound Identification
SMILES
CCOC(=O)C1=C(C)C(C(=O)OCC)=C(N\C(SC)=C(\C#N)C(=O)OC)S1
InChIKey
InChIKey=PYVJQAFOJUGDTP-JLHYYAGUSA-N
Formula
C17H20N2O6S2
Mass
412.48
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
Thiophene carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Thiophene carboxylic acids and derivatives
Alternative Parents
Vinylogous thioesters Vinylogous amides Methyl esters Heteroaromatic compounds Enoate esters Ketene acetals Sulfenyl compounds Nitriles Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Thiophene carboxylic acid or derivatives - Vinylogous thioester - Methyl ester - Enoate ester - Heteroaromatic compound - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Ketene acetal or derivatives - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organosulfur compound - Cyanide - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as thiophene carboxylic acids and derivatives. These are compounds containing a thiophene ring which bears a carboxylic acid group (or a salt/ester thereof).
External Descriptors
Not available