Compound Identification
SMILES
NC(=O)C1=NC(Br)=CC(SC2=CC=C(C=C2)[N+]([O-])=O)=C1
InChIKey
InChIKey=LFCSBHYQMLWJSH-UHFFFAOYSA-N
Formula
C12H8BrN3O3S
Mass
354.18
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
-
Class
Thioethers
-
Subclass
Aryl thioethers
- Level 5 Diarylthioethers
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Subclass
Aryl thioethers
-
Class
Thioethers
-
Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Thioethers
Subclass
Aryl thioethers
Intermediate Tree Nodes
Not available
Direct Parent
Diarylthioethers
Alternative Parents
Pyridinecarboxamides Nitrobenzenes Thiophenol ethers 2-heteroaryl carboxamides Nitroaromatic compounds 2-halopyridines Aryl bromides Heteroaromatic compounds Primary carboxylic acid amides Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic oxides Hydrocarbon derivatives Organic salts Organic zwitterions Organobromides Organonitrogen compounds Organooxygen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diarylthioether - Pyridine carboxylic acid or derivatives - Pyridinecarboxamide - Nitrobenzene - 2-heteroaryl carboxamide - Thiophenol ether - Nitroaromatic compound - 2-halopyridine - Monocyclic benzene moiety - Aryl bromide - Aryl halide - Pyridine - Benzenoid - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Carboxamide group - Primary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organobromide - Organic oxide - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as diarylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two aryl groups.
External Descriptors
Not available