Compound Identification
SMILES
CC1=C(C)C=C(CN2C(CN3CCCN(CC4=C(F)C=CC(Br)=C4)CC3)=NC3=CC=CC=C23)C=C1
InChIKey
InChIKey=FDPDBAQCVIAERK-UHFFFAOYSA-N
Formula
C29H32BrFN4
Mass
535.505
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
o-Xylenes Phenylmethylamines Benzylamines 1,4-diazepanes Aralkylamines Fluorobenzenes Bromobenzenes N-substituted imidazoles Aryl bromides Aryl fluorides Heteroaromatic compounds Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organobromides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - O-xylene - Xylene - Benzylamine - Phenylmethylamine - 1,4-diazepane - Bromobenzene - Aralkylamine - Diazepane - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Tertiary amine - Tertiary aliphatic amine - Azacycle - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Organofluoride - Organonitrogen 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