Compound Identification
SMILES
COC1=CC=C(C=C1)C1=CC(=NC(SCC(=O)CC(=O)OC(C)C)=C1C#N)C1=CC=CC=C1
InChIKey
InChIKey=PGQGSBOZHNECOL-UHFFFAOYSA-N
Formula
C26H24N2O4S
Mass
460.55
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
Phenoxy compounds 3-pyridinecarbonitriles Methoxybenzenes Anisoles Alkyl aryl ethers Alkylarylthioethers Beta-keto acids and derivatives Fatty acid esters 1,3-dicarbonyl compounds Heteroaromatic compounds Carboxylic acid esters Ketones Azacyclic compounds Monocarboxylic acids and derivatives Nitriles Sulfenyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyridine - 4-phenylpyridine - Anisole - Phenol ether - Phenoxy compound - 3-pyridinecarbonitrile - Methoxybenzene - Aryl thioether - Beta-keto acid - Alkylarylthioether - Fatty acid ester - Alkyl aryl ether - Monocyclic benzene moiety - Fatty acyl - Benzenoid - 1,3-dicarbonyl compound - Keto acid - Heteroaromatic compound - Carboxylic acid ester - Ketone - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Ether - Thioether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Cyanide - Organonitrogen compound - Organooxygen compound - Organosulfur 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