Compound Identification
SMILES
CC1=CC(C(=O)COC(=O)C2=CC=C(Cl)S2)=C(C)N1C1=NC=NN1
InChIKey
InChIKey=JMXXEUVCAXRPRX-UHFFFAOYSA-N
Formula
C15H13ClN4O3S
Mass
364.8
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
Aryl alkyl ketones 2,5-disubstituted thiophenes Substituted pyrroles Aryl chlorides Vinylogous amides Triazoles Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Thiophene carboxylic acid or derivatives - Aryl ketone - Aryl alkyl ketone - 2,5-disubstituted thiophene - Aryl chloride - Aryl halide - Substituted pyrrole - Azole - Pyrrole - 1,2,4-triazole - Heteroaromatic compound - Vinylogous amide - Ketone - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - 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