Compound Identification
SMILES
C[C@H]1CCC[C@@H](C)N1C(=O)COC(=O)C1=C(SCC2=NOC(C)=C2)N=CC=C1
InChIKey
InChIKey=RMMDEOOATSFARN-OKILXGFUSA-N
Formula
C20H25N3O4S
Mass
403.5
Taxonomic Classification
Taxonomy Tree
-
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
N-acylpiperidines Alkylarylthioethers Vinylogous thioesters Tertiary carboxylic acid amides Isoxazoles Heteroaromatic compounds Carboxylic acid esters Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-piperidine - Pyridine carboxylic acid - Aryl thioether - Alkylarylthioether - Piperidine - Vinylogous thioester - Azole - Isoxazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxylic acid ester - Carboxamide group - Sulfenyl compound - Thioether - Carboxylic acid derivative - Azacycle - Oxacycle - Carbonyl group - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen 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