Compound Identification
SMILES
CN1C(=O)C(C#N)=C(C)C(\C=C2/SC(=S)N(CC3=CC=C(F)C=C3)C2=O)=C1N1CCSCC1
InChIKey
InChIKey=ROFDUSUOJJXRAZ-ODLFYWEKSA-N
Formula
C23H21FN4O2S3
Mass
500.63
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 Pyridinones Aminopyridines and derivatives Methylpyridines Dihydropyridines Fluorobenzenes Thiomorpholines Thiazolidinethiones Aryl fluorides Cyclic dithiocarbamic acid esters Heteroaromatic compounds Lactams Dialkylthioethers Nitriles Carboxylic acids and derivatives Azacyclic compounds Organofluorides Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-pyridinecarbonitrile - Dialkylarylamine - Aminopyridine - Dihydropyridine - Methylpyridine - Fluorobenzene - Halobenzene - Pyridinone - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Hydropyridine - Thiazolidinethione - Benzenoid - 1,4-thiazinane - Cyclic dithiocarbamic acid ester - Heteroaromatic compound - Dithiocarbamic acid ester - Thiazolidine - Lactam - Thioether - Dialkylthioether - Carboxylic acid derivative - Azacycle - Nitrile - Carbonitrile - Organosulfur compound - Organohalogen compound - Organofluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Carbonyl group - Cyanide - Organic oxygen compound - Amine - Organooxygen 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