Compound Identification
SMILES
CCOC(=O)C1=C(C)N=C(N2CC(C2)C(=O)NS(=O)(=O)CC2=CC=C(OC)C=C2)C(=C1)C#N
InChIKey
InChIKey=HGAVMTCXGNYXAQ-UHFFFAOYSA-N
Formula
C22H24N4O6S
Mass
472.52
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
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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
3-pyridinecarbonitriles Anisoles Dialkylarylamines Methoxybenzenes Phenoxy compounds Aminopyridines and derivatives Methylpyridines Alkyl aryl ethers Imidolactams Aminosulfonyl compounds Heteroaromatic compounds Organosulfonic acids and derivatives Carboxylic acid esters Azetidines Azacyclic compounds Nitriles Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridine carboxylic acid - Phenoxy compound - Anisole - Dialkylarylamine - Phenol ether - 3-pyridinecarbonitrile - Methoxybenzene - Alkyl aryl ether - Aminopyridine - Methylpyridine - Benzenoid - Imidolactam - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Organosulfonic acid or derivatives - Sulfonyl - Heteroaromatic compound - Azetidine - Carboxylic acid ester - Nitrile - Carbonitrile - Ether - Carboxylic acid derivative - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Carbonyl group - Organic oxide - Organic nitrogen compound - Cyanide - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic 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