Compound Identification
SMILES
NC1=C(C#N)C(C2=CC=C(OCC(O)=O)C=C2)=C(C#N)C(=S)N1
InChIKey
InChIKey=PJFAEARTKUFIMY-UHFFFAOYSA-N
Formula
C15H10N4O3S
Mass
326.33
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
Phenoxyacetic acid derivatives 3-pyridinecarbonitriles Phenoxy compounds Phenol ethers Alkyl aryl ethers Aminopyridines and derivatives Dihydropyridines Thiolactams Heteroaromatic compounds Amino acids Nitriles Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organosulfur compounds Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-phenylpyridine - Phenoxyacetate - Phenoxy compound - 3-pyridinecarbonitrile - Phenol ether - Alkyl aryl ether - Aminopyridine - Dihydropyridine - Monocyclic benzene moiety - Hydropyridine - Benzenoid - Heteroaromatic compound - Thiolactam - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Ether - Azacycle - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Cyanide - Organic oxygen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary 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