Compound Identification
SMILES
CC1=C(C(C2=C(CCS2(=O)=O)N1)C1=CC(Br)=C(F)C=C1)C(O)=O
InChIKey
InChIKey=PKFRJISEUHGODA-UHFFFAOYSA-N
Formula
C15H13BrFNO4S
Mass
402.23
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thienopyridines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thienopyridines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thienopyridines
Alternative Parents
Bromobenzenes Fluorobenzenes Dihydropyridines Aryl bromides Aryl fluorides Vinylogous amides Sulfones Dihydrothiophenes Azacyclic compounds Monocarboxylic acids and derivatives Enamines Dialkylamines Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyridine - Bromobenzene - Dihydropyridine - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - 2,3-dihydrothiophene - Sulfone - Azacycle - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Enamine - Monocarboxylic acid or derivatives - Amine - Organic oxygen compound - Organobromide - Organofluoride - Carbonyl group - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thienopyridines. These are heterocyclic compounds containing a thiophene ring fused to a pyridine ring. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
External Descriptors
Not available