Compound Identification
SMILES
CC1=CC2=C(C=C1)N=C(N2)C1=NC(N)=C(C#N)C(=C1)C1CCOC1
InChIKey
InChIKey=DAEPPFFEXSVLPV-UHFFFAOYSA-N
Formula
C18H17N5O
Mass
319.368
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
3-pyridinecarbonitriles Aminopyridines and derivatives Imidolactams Benzenoids Oxolanes Imidazoles Heteroaromatic compounds Oxacyclic compounds Nitriles Dialkyl ethers Azacyclic compounds Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - 3-pyridinecarbonitrile - Aminopyridine - Pyridine - Imidolactam - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Oxolane - Dialkyl ether - Ether - Carbonitrile - Nitrile - Oxacycle - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Cyanide - Primary amine - 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