Compound Identification
SMILES
COC1=CC=C(C=CC(=O)N2N=C(N=C2NCC2=CC=CS2)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=FUSCILHTMCNLTA-UHFFFAOYSA-N
Formula
C23H20N4O2S
Mass
416.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids and derivatives
Alternative Parents
Phenyl-1,2,4-triazoles Styrenes Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Thiophenes Heteroaromatic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Phenyltriazole - Phenyl-1,2,4-triazole - Anisole - Phenol ether - Styrene - Phenoxy compound - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Thiophene - Triazole - 1,2,4-triazole - Ether - Organoheterocyclic compound - Azacycle - Amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available