Compound Identification
SMILES
COC(=O)COC1=CC(OC)=C(SCCCNC2=NC=C(C=C2)C2=CC=CC=C2)C=C1C
InChIKey
InChIKey=OBXBAODDEDDNEK-UHFFFAOYSA-N
Formula
C25H28N2O4S
Mass
452.57
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
Phenoxyacetic acid derivatives Thiophenol ethers Phenoxy compounds Anisoles Methoxybenzenes Toluenes Alkyl aryl ethers Alkylarylthioethers Aminopyridines and derivatives Imidolactams Heteroaromatic compounds Methyl esters Azacyclic compounds Monocarboxylic acids and derivatives Sulfenyl compounds Hydrocarbon derivatives Carbonyl compounds Amines Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-phenylpyridine - Phenoxyacetate - Thiophenol ether - Phenoxy compound - Methoxybenzene - Phenol ether - Anisole - Aryl thioether - Alkyl aryl ether - Alkylarylthioether - Toluene - Aminopyridine - Imidolactam - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Sulfenyl compound - Azacycle - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - 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