Compound Identification
SMILES
OC(=O)CCCCCN1C(=S)S\C(=C/C2=CN=CC(=C2)C2=C(F)C=CC(=C2)C(F)(F)F)C1=O
InChIKey
InChIKey=MIFWOCHIELAUNJ-NVMNQCDNSA-N
Formula
C22H18F4N2O3S2
Mass
498.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
- Subclass Phenylpyridines
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Class
Pyridines and derivatives
-
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
Trifluoromethylbenzenes Medium-chain fatty acids Fluorobenzenes Halogenated fatty acids Heterocyclic fatty acids Thiazolidinethiones Aryl fluorides Cyclic dithiocarbamic acid esters Heteroaromatic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organofluorides Organonitrogen compounds Organosulfur compounds Carbonyl compounds Organic oxides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-phenylpyridine - Trifluoromethylbenzene - Medium-chain fatty acid - Heterocyclic fatty acid - Halogenated fatty acid - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Thiazolidinethione - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Cyclic dithiocarbamic acid ester - Thiazolidine - Dithiocarbamic acid ester - Heteroaromatic compound - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - 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