Compound Identification
SMILES
COCCCNC1=C(N=NC2=NN(C=C2C#N)C2=NC=CC=N2)C(C)=C(C#N)C(NC2=C(C)C=C(C)C=C2C)=N1
InChIKey
InChIKey=RWGJWLZHSRBGRY-UHFFFAOYSA-N
Formula
C28H29N11O
Mass
535.616
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
- Subclass 3-pyridinecarbonitriles
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Class
Pyridines and derivatives
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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
Aniline and substituted anilines Secondary alkylarylamines Methylpyridines Aminopyridines and derivatives Pyrimidines and pyrimidine derivatives Imidolactams Pyrazoles Heteroaromatic compounds Azo compounds Propargyl-type 1,3-dipolar organic compounds Nitriles Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aniline or substituted anilines - 3-pyridinecarbonitrile - Aminopyridine - Secondary aliphatic/aromatic amine - Methylpyridine - Monocyclic benzene moiety - Imidolactam - Pyrimidine - Benzenoid - Heteroaromatic compound - Azole - Pyrazole - Azo compound - Azacycle - Dialkyl ether - Ether - Carbonitrile - Nitrile - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Cyanide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - 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