Compound Identification
SMILES
CN1C=NC=C1C(O)(C#CC1=CC=C(C=C1)C#N)C1=CC(=C(C=C1)C#N)C1=CC=CC=C1C
InChIKey
InChIKey=DUORQQSLNAGSSQ-UHFFFAOYSA-N
Formula
C28H20N4O
Mass
428.495
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Linear 1,3-diarylpropanoids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Linear 1,3-diarylpropanoids
Alternative Parents
Biphenylcarbonitriles Benzonitriles Toluenes Ynones N-substituted imidazoles Tertiary alcohols Heteroaromatic compounds Nitriles Azacyclic compounds Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Linear 1,3-diarylpropanoid - Biphenylcarbonitrile - Biphenyl - Benzonitrile - Toluene - Monocyclic benzene moiety - N-substituted imidazole - Ynone - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Tertiary alcohol - Nitrile - Carbonitrile - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Alcohol - Hydrocarbon derivative - Cyanide - Organic oxygen compound - Organic nitrogen compound - Aromatic alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.
External Descriptors
Not available