Compound Identification
SMILES
COC(=O)C1=C(NC(=O)CSC2=NN=C(COC3=C(C)C=CC(C)=C3)N2CC=C)SC=C1C1=CC=C(OC)C=C1
InChIKey
InChIKey=WMHUKRQQKBTAIL-UHFFFAOYSA-N
Formula
C29H30N4O5S2
Mass
578.7
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
p-Xylenes Phenoxy compounds Anisoles N-arylamides Methoxybenzenes Alkyl aryl ethers Alkylarylthioethers Vinylogous amides Triazoles Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Sulfenyl compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Aryl thioether - Anisole - Thiophene carboxylic acid or derivatives - P-xylene - Xylene - N-arylamide - Phenol ether - Methoxybenzene - Alkyl aryl ether - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Methyl ester - Heteroaromatic compound - Azole - 1,2,4-triazole - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Azacycle - Ether - Carboxylic acid derivative - Thioether - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - 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