Compound Identification
SMILES
NC(=O)CSC1=C(C#N)C(C2=CC=C(OCC(O)=O)C=C2)=C(C#N)C(N)=N1
InChIKey
InChIKey=VETJNSGLFLFRAU-UHFFFAOYSA-N
Formula
C17H13N5O4S
Mass
383.38
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 Alkylarylthioethers Aminopyridines and derivatives Imidolactams Heteroaromatic compounds Amino acids Primary carboxylic acid amides Monocarboxylic acids and derivatives Sulfenyl compounds Carboxylic acids Azacyclic compounds Nitriles Hydrocarbon derivatives Carbonyl compounds Organic oxides Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-phenylpyridine - Phenoxyacetate - Phenoxy compound - Aryl thioether - 3-pyridinecarbonitrile - Phenol ether - Alkyl aryl ether - Alkylarylthioether - Aminopyridine - Monocyclic benzene moiety - Imidolactam - Benzenoid - Heteroaromatic compound - Amino acid or derivatives - Primary carboxylic acid amide - Carboxamide group - Amino acid - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Azacycle - Sulfenyl compound - Thioether - Cyanide - Organic oxygen compound - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen 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