Compound Identification
SMILES
NC(=O)C(C(=O)C=CC1=CC=C(F)C=C1)=C1SCS1
InChIKey
InChIKey=VOXVHGDMYZVUME-UHFFFAOYSA-N
Formula
C13H10FNO2S2
Mass
295.35
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
Styrenes Fluorobenzenes Vinylogous thioesters Fatty amides Aryl fluorides Enones Acryloyl compounds Primary carboxylic acid amides Ketones Ketene acetals Dithietanes Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Styrene - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Vinylogous thioester - Fatty acyl - Benzenoid - Fatty amide - Acryloyl-group - Alpha,beta-unsaturated ketone - Enone - Carboxamide group - Dithietane - Primary carboxylic acid amide - Ketene acetal or derivatives - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organofluoride - Organic oxide - Hydrocarbon derivative - Organohalogen compound - 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