Compound Identification
SMILES
[O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F.CCOC(=O)C1=C(C[NH2+]CC2=C[NH+]=CS2)NC(C(=O)OC(C)(C)C)=C1CC
InChIKey
InChIKey=CYQOUIMVWWNTEL-UHFFFAOYSA-N
Formula
C23H29F6N3O8S
Mass
621.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrroles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Pyrrole carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrole carboxylic acids and derivatives
Alternative Parents
Aralkylamines Substituted pyrroles Vinylogous amides Thiazoles Quaternary ammonium salts Alpha-halocarboxylic acids Heteroaromatic compounds Amino acids and derivatives Carboxylic acid salts Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Dialkylamines Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic zwitterions Organofluorides Alkyl fluorides
Molecular Framework
Not available
Substituents
Pyrrole-3-carboxylic acid or derivatives - Pyrrole-2-carboxylic acid or derivatives - Aralkylamine - Substituted pyrrole - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Quaternary ammonium salt - Thiazole - Vinylogous amide - Azole - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid salt - Carboxylic acid ester - Secondary amine - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Secondary aliphatic amine - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrole carboxylic acids and derivatives. These are heterocyclic compounds containing a pyrrole ring bearing a carboxyl group (or a derivative thereof).
External Descriptors
Not available