Compound Identification
SMILES
CC(C)(C)C(=O)OC1=CC2=C(CC[N+]([O-])(CC3=CC=CC=C3Cl)C2)S1
InChIKey
InChIKey=JWKGWMSSNIFDDO-UHFFFAOYSA-N
Formula
C19H22ClNO3S
Mass
379.9
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
2,3,5-trisubstituted thiophenes Chlorobenzenes Pyridines and derivatives Aryl chlorides Trialkyl amine oxides Heteroaromatic compounds Carboxylic acid esters Trisubstituted amine oxides and derivatives Azacyclic compounds Monocarboxylic acids and derivatives Organic salts Organic zwitterions Carbonyl compounds Organic oxides Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyridine - 2,3,5-trisubstituted thiophene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Trialkyl amine oxide - Heteroaromatic compound - Thiophene - Carboxylic acid ester - Trisubstituted n-oxide - Carboxylic acid derivative - N-oxide - Azacycle - Monocarboxylic acid or derivatives - Organic zwitterion - Organohalogen compound - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic salt - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen 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