Compound Identification
SMILES
NCCC1=NC2=C(N1)C=C(C=C2)C1=NNC(=O)C=C1
InChIKey
InChIKey=PMQZOCCYGUHTAP-UHFFFAOYSA-N
Formula
C13H13N5O
Mass
255.281
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
2-arylethylamines Pyridazinones Aralkylamines Benzenoids Imidazoles Heteroaromatic compounds Lactams Azacyclic compounds Organooxygen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - 2-arylethylamine - Pyridazinone - Aralkylamine - Pyridazine - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Lactam - Azacycle - Organic oxide - Organic oxygen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic nitrogen compound - Hydrocarbon derivative - Amine - 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