Compound Identification
SMILES
CCOC(=O)C1=C(C)C(C(=O)OCC)=C(NC(=O)CSC2=NN=C(COC3=CC=C(Cl)C=C3)O2)S1
InChIKey
InChIKey=WIDLEWOFKWGPKH-UHFFFAOYSA-N
Formula
C22H22ClN3O7S2
Mass
540.0
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
Phenoxy compounds Phenol ethers N-arylamides Alkyl aryl ethers Alkylarylthioethers Chlorobenzenes Aryl chlorides Dicarboxylic acids and derivatives Vinylogous amides 1,3,4-oxadiazoles Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenol ether - Phenoxy compound - Aryl thioether - Thiophene carboxylic acid or derivatives - N-arylamide - Alkyl aryl ether - Halobenzene - Alkylarylthioether - Chlorobenzene - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Benzenoid - Monocyclic benzene moiety - Azole - Oxadiazole - Heteroaromatic compound - Vinylogous amide - 1,3,4-oxadiazole - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Oxacycle - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Ether - Thioether - Organooxygen compound - Organic oxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen 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