N-(6-(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-ylthio)imidazo[1,2-b]pyridazin-2-yl)cyclopropanecarboxamide → tert-Butyl 6-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)imidazo[1,2-b]pyridazin-2-ylcarbamate
반응식
[Br:29][c:30]1[cH:31][cH:32][c:33]2[n:34]([c:35]([S:36][c:37]3[cH:38][cH:39][c:40]4[n:41]([cH:42][c:43]([NH:44][C:45]([CH:46]5[CH2:47][CH2:48]5)=[O:49])[n:50]4)[n:51]3)[n:52][n:53]2)[cH:54]1.[I:1][c:2]1[cH:3][cH:4][c:5]2[n:6]([n:7]1)[cH:8][c:9]([NH:11][C:12]([O:13][C:14]([CH3:15])([CH3:16])[CH3:17])=[O:18])[n:10]2.[n:19]1[n:20][c:21]([SH:28])[n:22]2[c:23]1[cH:24][cH:25][cH:26][cH:27]2>>[c:2]1([S:28][c:21]2[n:20][n:19][c:23]3[n:22]2[cH:27][cH:26][cH:25][cH:24]3)[cH:3][cH:4][c:5]2[n:6]([n:7]1)[cH:8][c:9]([NH:11][C:12]([O:13][C:14]([CH3:15])([CH3:16])[CH3:17])=[O:18])[n:10]2참가 물질
4
반응물 3
생성물 1
출처 및 근거
- ORD 기록
- ord-16824c607fb947c4819b21c6ca4f96b3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)