Compound Identification
SMILES
CC1=C(CNCCCNN2C=NC3=CC=CC=C23)SC(C(F)=C)=C1Br
InChIKey
InChIKey=BTZIPUXWTCCWEC-UHFFFAOYSA-N
Formula
C18H20BrFN4S
Mass
423.35
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
Aralkylamines N-substituted imidazoles Benzenoids Aryl bromides Thiophenes Heteroaromatic compounds Vinyl fluorides Fluoroalkenes Dialkylamines Azacyclic compounds Organofluorides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Aralkylamine - Aryl bromide - Aryl halide - Benzenoid - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Thiophene - Azacycle - Fluoroalkene - Secondary aliphatic amine - Haloalkene - Vinyl halide - Secondary amine - Vinyl fluoride - Hydrocarbon derivative - Amine - Organohalogen compound - Organobromide - Organofluoride - Organonitrogen compound - Organic nitrogen compound - 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