Compound Identification
SMILES
CC(C)(O)C1=CC(F)=C(C=C1)C1=CC(C(N)=O)=C(NC2=CC=CC(CNCC(O)C(F)(F)F)=N2)S1
InChIKey
InChIKey=HKUWCXBALDXZKM-UHFFFAOYSA-N
Formula
C23H24F4N4O3S
Mass
512.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
- Subclass 2-pyridylmethylamines
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Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
2-pyridylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
6-substituted-2-pyridinylmethylamines
Alternative Parents
Phenylpropanes 2,3,5-trisubstituted thiophenes Thiophene carboxamides Aminopyridines and derivatives Aralkylamines Fluorobenzenes N-arylated-2-aminothiophenes Aryl fluorides Imidolactams Vinylogous amides Tertiary alcohols Heteroaromatic compounds Fluorohydrins Primary carboxylic acid amides Secondary alcohols 1,2-aminoalcohols Amino acids and derivatives Dialkylamines Azacyclic compounds Organofluorides Aromatic alcohols Alkyl fluorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
6-substituted-2-pyridinylmethylamine - Phenylpropane - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Aminopyridine - Fluorobenzene - Halobenzene - N-arylated-2-aminothiophene - Aralkylamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - 2-aminothiophene - Benzenoid - Imidolactam - Heteroaromatic compound - Tertiary alcohol - Vinylogous amide - Thiophene - Secondary alcohol - Primary carboxylic acid amide - Amino acid or derivatives - 1,2-aminoalcohol - Carboxamide group - Halohydrin - Fluorohydrin - Azacycle - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organohalogen compound - Alkyl fluoride - Alcohol - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Aromatic alcohol - Alkyl halide - Amine - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 6-substituted-2-pyridinylmethylamines. These are aromatic heterocyclic compounds contaning a pyridine ring which is substituted at the 2-position with a methylamine, and at the 6-position with any non-hydrogen atom.
External Descriptors
Not available