Compound Identification
SMILES
OC(=O)C1=CN=C(S1)C1=NC=C(C2=CC=CC=C2)C(=C1)C#N
InChIKey
InChIKey=YYMABFKUUXVMTB-UHFFFAOYSA-N
Formula
C16H9N3O2S
Mass
307.33
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
Thiazolecarboxylic acids and derivatives 2,5-disubstituted thiazoles Benzene and substituted derivatives Heteroaromatic compounds Nitriles Carboxylic acids Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-phenylpyridine - Thiazolecarboxylic acid or derivatives - 2,5-disubstituted 1,3-thiazole - Monocyclic benzene moiety - Benzenoid - Azole - Thiazole - Heteroaromatic compound - Nitrile - Carbonitrile - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organic oxide - Cyanide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen 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