Compound Identification
SMILES
[O-][N+](=O)C1=C(Br)C=CC(C=C2SC3=[N+](C2=O)C2=CC=CC=C2N3)=C1
InChIKey
InChIKey=MVZFZQOAEKQMGT-UHFFFAOYSA-O
Formula
C16H9BrN3O3S
Mass
403.23
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzimidazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzimidazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzimidazoles
Alternative Parents
Nitrobenzenes Aryl thioethers Nitroaromatic compounds Bromobenzenes N-acylimidazoles Aryl bromides Heteroaromatic compounds Lactams Thioenol ethers Organic oxoazanium compounds Azacyclic compounds Organic salts Organobromides Hydrocarbon derivatives Organonitrogen compounds Organooxygen compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Nitrobenzene - Aryl thioether - Nitroaromatic compound - N-acylimidazole - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Azole - Heteroaromatic compound - Imidazole - Thioenolether - Lactam - Organic nitro compound - C-nitro compound - Azacycle - Organic oxoazanium - Organonitrogen compound - Organooxygen compound - Organic salt - Organohalogen compound - Organic oxygen compound - Organobromide - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).
External Descriptors
Not available