Compound Identification
SMILES
CC1=C(SC(Br)=C1C(Cl)=O)[N+]([O-])=O
InChIKey
InChIKey=PPXHPYXVCMJCOJ-UHFFFAOYSA-N
Formula
C6H3BrClNO3S
Mass
284.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiophenes
-
Subclass
Nitrothiophenes
- Level 5 2-nitrothiophenes
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Subclass
Nitrothiophenes
-
Class
Thiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
Nitrothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
2-nitrothiophenes
Alternative Parents
Thiophene carboxylic acids and derivatives Nitroaromatic compounds Aryl bromides Vinylogous halides Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Acyl chlorides Organic oxoazanium compounds Organooxygen compounds Organic salts Organic oxides Organobromides Hydrocarbon derivatives Organochlorides Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-nitrothiophene - Nitroaromatic compound - Thiophene carboxylic acid or derivatives - Aryl bromide - Aryl halide - Heteroaromatic compound - Vinylogous halide - Organic nitro compound - C-nitro compound - Acyl chloride - Acyl halide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organobromide - Organohalogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-nitrothiophenes. These are aromatic heterocyclic compound containing a nitro group attached to a thiophene ring a the 2-position.
External Descriptors
Not available