Compound Identification
SMILES
CC1=CC=C(C=C1)C1=NN=C(SC2=NC3=C(C=CC(=C3)[N+]([O-])=O)N2C2=CC=C(F)C=C2)C2=CC=CC=C12
InChIKey
InChIKey=GJKLXMVLRFXVGE-UHFFFAOYSA-N
Formula
C28H18FN5O2S
Mass
507.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzimidazoles
- Subclass Phenylbenzimidazoles
-
Class
Benzimidazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzimidazoles
Subclass
Phenylbenzimidazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbenzimidazoles
Alternative Parents
Phenylpyridazines Diarylthioethers Phenylimidazoles Phthalazines Nitroaromatic compounds Toluenes Fluorobenzenes Aryl fluorides N-substituted imidazoles Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organofluorides Organic salts Organonitrogen compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbenzimidazole - Phenylpyridazine - 1-phenylimidazole - Diarylthioether - Phthalazine - Aryl thioether - Nitroaromatic compound - Toluene - Fluorobenzene - Halobenzene - Pyridazine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Azole - Imidazole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Sulfenyl compound - Thioether - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organofluoride - Organonitrogen compound - Organosulfur compound - Organic salt - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbenzimidazoles. These are compounds containing a phenylbenzimidazole skeleton, which consists of a benzimidazole moiety where its imidazole ring is attached to a phenyl group.
External Descriptors
Not available