Compound Identification
SMILES
C[N+]1=C2SCC(=NN2C2=CC=CC=C12)C1=CC=C(Br)C=C1
InChIKey
InChIKey=XNALFFZVFIHSAM-UHFFFAOYSA-N
Formula
C16H13BrN3S
Mass
359.26
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
S-alkylisothiosemicarbazones Bromobenzenes Alkylarylthioethers Thiosemicarbazones N-substituted imidazoles Aryl bromides Heteroaromatic compounds Azacyclic compounds Organobromides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Aryl thioether - S-alkylisothiosemicarbazone - Alkylarylthioether - Bromobenzene - Halobenzene - Aryl bromide - Isothiosemicarbazone - Aryl halide - Benzenoid - Monocyclic benzene moiety - Thiosemicarbazone - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Azacycle - Thioether - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organobromide - Organohalogen compound - 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