Compound Identification
SMILES
CN1C(=O)C(C#N)=C(C)C(\C=C2\SC(=S)N(C3CCS(=O)(=O)C3)C2=O)=C1N1CCCC1
InChIKey
InChIKey=BDLZATRHUAGGOS-CXUHLZMHSA-N
Formula
C20H22N4O4S3
Mass
478.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
- Subclass 3-pyridinecarbonitriles
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Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
3-pyridinecarbonitriles
Intermediate Tree Nodes
Not available
Direct Parent
3-pyridinecarbonitriles
Alternative Parents
Dialkylarylamines Aminopyridines and derivatives Dihydropyridines Pyridinones Methylpyridines Thiazolidinethiones Thiolanes Cyclic dithiocarbamic acid esters Sulfones Pyrrolidines Heteroaromatic compounds Lactams Carboxylic acids and derivatives Azacyclic compounds Nitriles Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-pyridinecarbonitrile - Dialkylarylamine - Aminopyridine - Dihydropyridine - Pyridinone - Methylpyridine - Hydropyridine - Thiazolidinethione - Cyclic dithiocarbamic acid ester - Pyrrolidine - Heteroaromatic compound - Sulfone - Dithiocarbamic acid ester - Thiolane - Thiazolidine - Lactam - Nitrile - Carbonitrile - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Cyanide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 3-pyridinecarbonitriles. These are organic compounds containing a pyridine ring substituted at the 3-position by a carbonitrile group.
External Descriptors
Not available