Compound Identification
SMILES
COC(=O)C1=C(NC(=O)C=CC2=CC=C(C=C2)[N+]([O-])=O)SC2=C1CC(C)(C)NC2(C)C
InChIKey
InChIKey=PPZSACCUYFKAEP-UHFFFAOYSA-N
Formula
C22H25N3O5S
Mass
443.52
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
Thienopyridines Nitrobenzenes Thiophene carboxylic acids and derivatives Styrenes N-arylamides Nitroaromatic compounds Aralkylamines Vinylogous amides Heteroaromatic compounds Methyl esters Secondary carboxylic acid amides Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Dialkylamines Organic oxoazanium compounds Organic zwitterions Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid amide - Nitrobenzene - Thienopyridine - Nitroaromatic compound - Styrene - Thiophene carboxylic acid or derivatives - N-arylamide - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Thiophene - Vinylogous amide - Methyl ester - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Carboxylic acid derivative - Secondary aliphatic amine - Organic oxoazanium - Secondary amine - Azacycle - Organic nitrogen compound - Organic zwitterion - Organic oxide - Organic salt - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Amine - Aromatic heteropolycyclic 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