Compound Identification
SMILES
CC(=O)N1N2C=NN=C2SC(C(C)=O)=C1C1=CC=C(C=C1)C1CCCCC1
InChIKey
InChIKey=QGGKIGZOCOWXCP-UHFFFAOYSA-N
Formula
C20H22N4O2S
Mass
382.48
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
Aryl thioethers Benzene and substituted derivatives Triazoles Heteroaromatic compounds Acetamides Thioenol ethers Ketones Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Aryl thioether - Monocyclic benzene moiety - Benzenoid - Azole - 1,2,4-triazole - Acetamide - Heteroaromatic compound - Thioenolether - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic 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