Compound Identification
SMILES
[O-][N+](=O)C1=CC=CC(NC(=S)NNC(=O)C2=CC=C(Br)O2)=C1
InChIKey
InChIKey=IASAZFISZITEQW-UHFFFAOYSA-N
Formula
C12H9BrN4O4S
Mass
385.19
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
Furoic acid and derivatives Nitroaromatic compounds Aryl bromides Thiosemicarbazides Heteroaromatic compounds Carboxylic acid hydrazides Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Organic salts Organic oxides Organic zwitterions Hydrocarbon derivatives Organobromides Organooxygen compounds Organopnictogen compounds Organosulfur compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Furoic acid or derivatives - Nitroaromatic compound - Aryl bromide - Aryl halide - Furan - Heteroaromatic compound - Thiosemicarbazide - Carboxylic acid hydrazide - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Oxacycle - Organic oxoazanium - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organosulfur compound - Organic zwitterion - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors
Not available