Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(C=C1)C1=CC(=C(C#N)C(=S)N1)C(F)(F)F
InChIKey
InChIKey=NVFPTGXVLWJQAB-UHFFFAOYSA-N
Formula
C13H6F3N3O2S
Mass
325.27
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
- Subclass Phenylpyridines
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Class
Pyridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Phenylpyridines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyridines
Alternative Parents
Nitrobenzenes 3-pyridinecarbonitriles Nitroaromatic compounds Dihydropyridines Thiolactams Heteroaromatic compounds Nitriles Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic oxides Organofluorides Organosulfur compounds Hydrocarbon derivatives Alkyl fluorides Organic salts Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyridine - Nitrobenzene - Nitroaromatic compound - 3-pyridinecarbonitrile - Dihydropyridine - Monocyclic benzene moiety - Hydropyridine - Benzenoid - Heteroaromatic compound - Thiolactam - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carbonitrile - Azacycle - Nitrile - Organic oxoazanium - Organic salt - Alkyl halide - Organonitrogen compound - Organofluoride - Organosulfur compound - Organohalogen compound - Organic oxide - Alkyl fluoride - Hydrocarbon derivative - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
External Descriptors
Not available