Compound Identification
SMILES
CC(C)(C)C#CC1=CC(NC2CCC(CC2)OC2=NC(=CC=C2)S(C)(=O)=O)=C(S1)C(O)=O
InChIKey
InChIKey=QKJRPWSSFHAFQX-UHFFFAOYSA-N
Formula
C23H28N2O5S2
Mass
476.61
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiophenes
-
Subclass
Thiophene carboxylic acids and derivatives
- Level 5 Thiophene carboxylic acids
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Subclass
Thiophene carboxylic acids and derivatives
-
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
Alternative Parents
2,3,5-trisubstituted thiophenes Secondary alkylarylamines Alkyl aryl ethers Cyclohexylamines Pyridines and derivatives Aminothiophenes Vinylogous amides Sulfones Heteroaromatic compounds Amino acids Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Thiophene carboxylic acid - 2,3,5-trisubstituted thiophene - Alkyl aryl ether - Cyclohexylamine - Secondary aliphatic/aromatic amine - Aminothiophene - Pyridine - Heteroaromatic compound - Vinylogous amide - Sulfonyl - Sulfone - Amino acid - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Secondary amine - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Amine - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as thiophene carboxylic acids. These are compounds containing a thiophene ring which bears a carboxylic acid group.
External Descriptors
Not available