Compound Identification
SMILES
OC12CC(C3COC1O3)N1C(NC3=CC=CC=C13)=N2
InChIKey
InChIKey=QGHPNPRMVWMCGJ-UHFFFAOYSA-N
Formula
C13H13N3O3
Mass
259.265
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
Oxepanes Oxanes Monosaccharides Hydropyrimidines Benzenoids 1,3-dioxolanes Guanidines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Alkanolamines Acetals Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Oxepane - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Monosaccharide - Oxane - Benzenoid - Meta-dioxolane - Guanidine - Organic 1,3-dipolar compound - Azacycle - Oxacycle - Alkanolamine - Acetal - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organic oxygen 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