Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC1=CC=CC=C1[C@H](C#CC1=CC=CC=C1)[NH+]1CCOCC1
InChIKey
InChIKey=QBTFFVZEKPTZAR-SANMLTNESA-O
Formula
C26H27N2O3S
Mass
447.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Linear 1,3-diarylpropanoids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Linear 1,3-diarylpropanoids
Alternative Parents
P-toluenesulfonamides Benzenesulfonamides Sulfanilides Benzenesulfonyl compounds Aralkylamines Organosulfonamides Morpholines Aminosulfonyl compounds Quaternary ammonium salts Trialkylamines Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Linear 1,3-diarylpropanoid - P-toluenesulfonamide - Benzenesulfonamide - Sulfanilide - Tosyl compound - Benzenesulfonyl group - Toluene - Aralkylamine - Monocyclic benzene moiety - Morpholine - Benzenoid - Oxazinane - Organosulfonic acid amide - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Tertiary aliphatic amine - Azacycle - Oxacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Hydrocarbon derivative - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organic oxide - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.
External Descriptors
Not available