UNPD170717
AlkaPlorer ID: AK075714
Synonym: None
IUPAC Name: N-methyl-N-[2-[4-(3-methylbut-2-enoxy)phenyl]ethyl]-3-methylsulfonylprop-2-enamide
Structure
SMILES: CC(C)=CCOC1=CC=C(CCN(C)C(=O)C=CS(C)(=O)=O)C=C1
InChI: InChI=1S/C18H25NO4S/c1-15(2)10-13-23-17-7-5-16(6-8-17)9-12-19(3)18(20)11-14-24(4,21)22/h5-8,10-11,14H,9,12-13H2,1-4H3
InChIKey: NKBBYRJYKGXDCB-UHFFFAOYSA-N
Reference
Sulphones derived from methylthiopropenoic acid amides from Glycosmis angustifolia
PubChem CID: 162893729
LOTUS: LTS0101921
COCONUT: CNP0160918
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Glycosmis angustifolia | Glycosmis | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 351.468
TPSA？: 63.68
MolLogP？: 2.5908000000000007
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|