Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(S1)\C=N\NC(=O)C1=NN(CC2=CC=C(Cl)C=C2)C=C1Br
InChIKey
InChIKey=VUZXVIATJSELBV-FBCYGCLPSA-N
Formula
C16H11BrClN5O3S
Mass
468.71
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiophenes
-
Subclass
Nitrothiophenes
- Level 5 2-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
2-nitrothiophenes
Alternative Parents
Pyrazole-5-carboxamides Nitroaromatic compounds 2,5-disubstituted thiophenes Chlorobenzenes Aryl bromides Aryl chlorides Vinylogous halides Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids and derivatives Organic oxoazanium compounds Hydrocarbon derivatives Organobromides Organochlorides Organonitrogen compounds Organic zwitterions Organic oxides Organooxygen compounds Organic salts
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-nitrothiophene - Pyrazole-5-carboxamide - Nitroaromatic compound - Chlorobenzene - Halobenzene - 2,5-disubstituted thiophene - Aryl halide - Aryl bromide - Aryl chloride - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Pyrazole - Vinylogous halide - Azole - Organic nitro compound - C-nitro compound - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxygen compound - Organobromide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - 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