Compound Identification
SMILES
CC1=CC(\C=C\C(N)=O)=CC(C)=C1NC1=C(C)N=NC(NC2=CC=C(C=C2)C#N)=N1
InChIKey
InChIKey=LRMJRMOEAWPEAX-RMKNXTFCSA-N
Formula
C22H21N7O
Mass
399.458
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid amides
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Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acid amides
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acid amides
Alternative Parents
m-Xylenes Styrenes Aniline and substituted anilines Benzonitriles Aminotriazines 1,2,4-triazines Imidolactams Heteroaromatic compounds Primary carboxylic acid amides Amino acids and derivatives Secondary amines Nitriles Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid amide - Benzonitrile - M-xylene - Xylene - Styrene - Aniline or substituted anilines - Aminotriazine - Monocyclic benzene moiety - Triazine - Benzenoid - 1,2,4-triazine - Imidolactam - Heteroaromatic compound - Amino acid or derivatives - Primary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Nitrile - Carbonitrile - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Cyanide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acid amides. These are amides of cinnamic acids. Cinnamic acid is an aromatic compound containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available