Compound Identification
SMILES
NC1=C(C#N)C(=CC(=N1)C1=CC(=CC=C1)[N+]([O-])=O)C1=CC(Br)=CS1
InChIKey
InChIKey=XXSGDAVADDCEPG-UHFFFAOYSA-N
Formula
C16H9BrN4O2S
Mass
401.24
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
Nitrobenzenes 3-pyridinecarbonitriles Nitroaromatic compounds Aminopyridines and derivatives Aryl bromides Imidolactams Thiophenes Heteroaromatic compounds Nitriles Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Organobromides Hydrocarbon derivatives Primary amines Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyridine - Nitrobenzene - Nitroaromatic compound - 3-pyridinecarbonitrile - Aminopyridine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Heteroaromatic compound - Thiophene - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carbonitrile - Nitrile - Azacycle - Organic oxoazanium - Organic salt - Organobromide - Organonitrogen compound - Organohalogen compound - Hydrocarbon derivative - Amine - Primary amine - Organic nitrogen compound - Organic oxide - Cyanide - Organic oxygen compound - Organic zwitterion - Aromatic heteromonocyclic 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