Compound Identification
SMILES
CCN1N=CC(Cl)=C1C(=O)NC(=S)NC1=C(C(=O)OC)C2=C(CCCCCC2)S1
InChIKey
InChIKey=XRTKAEZABIQYDX-UHFFFAOYSA-N
Formula
C19H23ClN4O3S2
Mass
454.99
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
Pyrazole-5-carboxamides Aryl chlorides Vinylogous halides Vinylogous amides Methyl esters Heteroaromatic compounds Thioureas Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thiophene carboxylic acid or derivatives - Pyrazole-5-carboxamide - Aryl chloride - Aryl halide - Azole - Pyrazole - Methyl ester - Vinylogous halide - Vinylogous amide - Heteroaromatic compound - Thiourea - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organic oxide - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic 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