Compound Identification
SMILES
CCOC(=O)NNC1=NC(=NC2=C1SC1=C2C(C2=CC=CC=C2)=C(C#N)C(OCC)=N1)C1=CC=CC=C1[N+]([O-])=O
InChIKey
InChIKey=JQNPFODQBUIUNO-UHFFFAOYSA-N
Formula
C27H21N7O5S
Mass
555.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
- Subclass Phenylpyridines
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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
Phenylpyridines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyridines
Alternative Parents
Thienopyrimidines Thienopyridines Nitrobenzenes Nitroaromatic compounds Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Imidolactams Thiophenes Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Nitriles Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylpyridine - Nitrobenzene - Thienopyridine - Thienopyrimidine - Nitroaromatic compound - Alkyl aryl ether - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Imidolactam - Heteroaromatic compound - Thiophene - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Ether - Carbonitrile - Nitrile - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic oxygen compound - Cyanide - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic zwitterion - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
External Descriptors
Not available