Compound Identification
SMILES
COC(=O)C1=CN(C)C2=CN=C(C=C12)C(C)SC1=NC(=CC(N)=N1)C(F)(F)F
InChIKey
InChIKey=DQUCLIIKSUWGER-UHFFFAOYSA-N
Formula
C17H16F3N5O2S
Mass
411.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolopyridines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyridines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolopyridines
Alternative Parents
Pyrrole carboxylic acids and derivatives Alkylarylthioethers Aminopyrimidines and derivatives Pyridines and derivatives Imidolactams N-methylpyrroles Vinylogous amides Heteroaromatic compounds Methyl esters Amino acids and derivatives Sulfenyl compounds Azacyclic compounds Organofluorides Alkyl fluorides Organooxygen compounds Primary amines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyridine - Aryl thioether - Pyrrole-3-carboxylic acid or derivatives - Aminopyrimidine - Alkylarylthioether - N-methylpyrrole - Pyridine - Pyrimidine - Substituted pyrrole - Imidolactam - Methyl ester - Heteroaromatic compound - Vinylogous amide - Pyrrole - Amino acid or derivatives - Carboxylic acid ester - Sulfenyl compound - Azacycle - Thioether - Carboxylic acid derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl fluoride - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Alkyl halide - Amine - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolopyridines. These are compounds containing a pyrrolopyridine moiety, which consists of a pyrrole ring fused to a pyridine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
External Descriptors
Not available