Compound Identification
SMILES
CC(=O)NNC1=NC(C)=C(S1)C(=O)C=CC1=CC=CC=C1Cl
InChIKey
InChIKey=SPDCZZMATIQLGL-UHFFFAOYSA-N
Formula
C15H14ClN3O2S
Mass
335.81
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 Aryl ketones 2,4,5-trisubstituted thiazoles Chlorobenzenes Aryl chlorides Heteroaromatic compounds Enones Acryloyl compounds Acetamides Carboxylic acid hydrazides Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - 2,4,5-trisubstituted 1,3-thiazole - Styrene - Aryl ketone - Halobenzene - Chlorobenzene - Monocyclic benzene moiety - Aryl halide - Benzenoid - Aryl chloride - Acetamide - Alpha,beta-unsaturated ketone - Thiazole - Acryloyl-group - Enone - Azole - Heteroaromatic compound - Carboxylic acid hydrazide - Ketone - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - 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