Chloride → Methyl 6-[3-[4-(Diphenylmethoxy)piperidino]propylamino][1,2,4]triazolo[1,5-b]pyridazine-2-carboxylate
반응식
[CH2:39]([N:40]([CH:41]([CH3:42])[CH3:43])[CH:44]([CH3:45])[CH3:46])[CH3:47].[CH3:50][N:51]([CH3:52])[CH:53]=[O:54].[Cl-:49].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[n:6]([n:7]1)[n:8][c:9]([C:11](=[O:12])[O:13][CH3:14])[n:10]2.[Na+:48].[OH2:55].[c:15]1([CH:21]([O:22][CH:23]2[CH2:24][CH2:25][N:26]([CH2:29][CH2:30][CH2:31][NH2:32])[CH2:27][CH2:28]2)[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[cH:16][cH:17][cH:18][cH:19][cH:20]1>>[c:2]1([NH:32][CH2:31][CH2:30][CH2:29][N:26]2[CH2:25][CH2:24][CH:23]([O:22][CH:21]([c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[CH2:28][CH2:27]2)[cH:3][cH:4][c:5]2[n:6]([n:7]1)[n:8][c:9]([C:11](=[O:12])[O:13][CH3:14])[n:10]2참가 물질
8
반응물 7
생성물 1
출처 및 근거
- ORD 기록
- ord-8d3272b2b159466b86c125785af72aad
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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