| Properties | Image |
|---|
| MNX_ID | MNXM156117 |
 |
| reference | keggD:D02236 |
| formula | C23H27Cl2F3N2OS |
| global charge | 0 |
| mol weight | 507.449 |
| InChIKey | IOVDQEIIMOZNNA-MHKBYHAFSA-N |
| InChI | InChI=1S/C23H25F3N2OS.2ClH/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29;;/h1-2,4-8,16,29H,3,9-15H2;2*1H/b18-5-;; |
| SMILES | Cl.Cl.OCCN1CCN(CC/C=C2/C3=C(C=CC=C3)SC3=C2C=C(C(F)(F)F)C=C3)CC1 |
MNX internals
| InChI (mnx) | InChI=1/C23H25F3N2OS.2ClH/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29;;/h1-2,4-8,16,29H,3,9-15H2;2*1H/b18-5-;; |
 |
| SMILES (mnx) | [CH:1]1=[CH:2][CH:6]=[C:21]2[C:19](=[CH:4]1)/[C:18](=[CH:5]/[CH2:3][CH2:9][N:27]1[CH2:10][CH2:12][N:28]([CH2:14][CH2:15][OH:29])[CH2:13][CH2:11]1)[C:20]1=[CH:16][C:17]([C:23]([F:24])([F:25])[F:26])=[CH:7][CH:8]=[C:22]1[S:30]2.[ClH:31].[ClH:32] |
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