Compound Identification
SMILES
CCOC(=O)C1=C(NC(=O)COC2=C(Br)C(C)=C(Cl)C(C)=C2)SC2=C1CCC(C)C2
InChIKey
InChIKey=WBAWCBIGJFPYMP-UHFFFAOYSA-N
Formula
C22H25BrClNO4S
Mass
514.86
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
N-arylamides Phenol ethers Phenoxy compounds m-Xylenes Alkyl aryl ethers Chlorobenzenes Bromobenzenes Aryl bromides Aryl chlorides Heteroaromatic compounds Vinylogous amides Carboxylic acid esters Secondary carboxylic acid amides Organochlorides Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - M-xylene - Xylene - Phenol ether - Thiophene carboxylic acid or derivatives - N-arylamide - Alkyl aryl ether - Halobenzene - Chlorobenzene - Bromobenzene - Aryl bromide - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Vinylogous amide - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Ether - Carboxylic acid derivative - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Organohalogen compound - Organobromide - 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