Compound Identification
SMILES
CC1=C(C=C2OC(=O)C3=C2C=C(C)NC3=S)C(C)=C(N1)C#N
InChIKey
InChIKey=KDHPQGOOBGWHPN-UHFFFAOYSA-N
Formula
C16H13N3O2S
Mass
311.36
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
-
Subclass
Pyridinecarboxylic acids and derivatives
- Level 5 Pyridinecarboxylic acids
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Subclass
Pyridinecarboxylic acids and derivatives
-
Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinecarboxylic acids
Alternative Parents
Methylpyridines Substituted pyrroles Vinylogous amides Thiolactams Heteroaromatic compounds Enol esters Lactones Oxacyclic compounds Nitriles Azacyclic compounds Organosulfur compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridine carboxylic acid - Methylpyridine - Substituted pyrrole - Enol ester - Pyrrole - Heteroaromatic compound - Thiolactam - Vinylogous amide - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Cyanide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid group.
External Descriptors
Not available