Compound Identification
SMILES
[O-][N+](=O)C1=CSC(=C1)S(=O)(=O)NCCNC1=NC(Cl)=NC=C1Br
InChIKey
InChIKey=DXVRZFQCEMUWSZ-UHFFFAOYSA-N
Formula
C10H9BrClN5O4S2
Mass
442.69
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiophenes
-
Subclass
Nitrothiophenes
- Level 5 3-nitrothiophenes
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Subclass
Nitrothiophenes
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Class
Thiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
Nitrothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
3-nitrothiophenes
Alternative Parents
Nitroaromatic compounds 2-halopyrimidines Aminopyrimidines and derivatives Organosulfonamides Aryl bromides Aryl chlorides Imidolactams Aminosulfonyl compounds Heteroaromatic compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic oxides Organochlorides Hydrocarbon derivatives Amines Organic salts Organic zwitterions Organobromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-nitrothiophene - Nitroaromatic compound - Halopyrimidine - Aminopyrimidine - 2-halopyrimidine - Aryl chloride - Aryl halide - Imidolactam - Pyrimidine - Organosulfonic acid amide - Aryl bromide - Heteroaromatic compound - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Aminosulfonyl compound - Organic nitro compound - C-nitro compound - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organochloride - Organobromide - Organic nitrogen compound - Organohalogen compound - Organic salt - Amine - Hydrocarbon derivative - Organosulfur compound - Organic oxygen compound - Organic oxide - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 3-nitrothiophenes. These are aromatic heterocyclic compound containing a nitro group attached to a thiophene ring a the 3-position.
External Descriptors
Not available