| Properties | Image | Occurences in reactions |
MNX_ID | MNXM43388 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C20H21BrFN3OS |
charge | 0 |
mass | 449.05727 |
reference | keggD:D09324 |
InChIKey | BGJMKHPWCFXMOW-UHFFFAOYSA-N |
InChI | InChI=1S/C20H21BrFN3OS/c1-12-17(27-20(13(2)22)19(12)21)11-23-8-5-9-24-18-10-16(26)14-6-3-4-7-15(14)25-18/h3-4,6-7,10,23H,2,5,8-9,11H2,1H3,(H2,24,25,26) |
SMILES | C=C(F)c1sc(CNCCCNc2cc(=O)c3ccccc3[nH]2)c(C)c1Br |
|