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Chloride → 2-{5-Bromo-6-oxo-4-[2-(tricyclo[3.3.1.13,7]dec-1-yl)ethoxy]pyridazin-1(6H)-yl}-N-(pyridin-4-ylmethyl)acetamide

HRID 153734
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반응식

HRID 153734 반응식
[Br:1][c:2]1[cH:3][n:4][n:5]([CH2:10][C:11](=[O:12])[NH:13][CH2:14][c:15]2[cH:16][cH:17][n:18][cH:19][cH:20]2)[c:6](=[O:9])[c:7]1[Br:8].[C:21]12([CH2:31][CH2:32][OH:33])[CH2:22][CH:23]3[CH2:24][CH:25]([CH2:26][CH:27]([CH2:28]1)[CH2:29]3)[CH2:30]2.[CH2:38]1[O:39][CH2:40][CH2:41][O:42][CH2:43]1.[Cl-:37].[Na+:35].[Na+:36].[OH-:34]>>[c:2]1([O:33][CH2:32][CH2:31][C:21]23[CH2:22][CH:23]4[CH2:24][CH:25]([CH2:26][CH:27]([CH2:28]2)[CH2:29]4)[CH2:30]3)[cH:3][n:4][n:5]([CH2:10][C:11](=[O:12])[NH:13][CH2:14][c:15]2[cH:16][cH:17][n:18][cH:19][cH:20]2)[c:6](=[O:9])[c:7]1[Br:8]
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참가 물질

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반응물 6

HCID 312ChlorideHCID 923Sodium Ion2회HCID 961HydroxideHCID 312751,4-DioxaneHCID 1108102-(Tricyclo(3.3.1.1'3,7)dec-1-yl)ethanolHCID 595743872-(4,5-Dibromo-6-oxopyridazin-1(6H)-yl)-N-(pyridin-4-ylmethyl)acetamide

생성물 1

HCID 59574243
2-{5-Bromo-6-oxo-4-[2-(tricyclo[3.3.1.13,7]dec-1-yl)ethoxy]pyridazin-1(6H)-yl}-N-(pyridin-4-ylmethyl)acetamide

출처 및 근거

ORD 기록
ord-968fcd12e6c047b4af33a4c38bb31b8f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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