1-((Tert-butoxy)carbonyl)-5-phenylpyrrolidine-2-carboxylic acid → Tert-butyl 2-[[2-[6-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]pyrimidin-4-yl]-5-(trifluoromethyl)phenyl]carbamoyl]-5-phenylpyrrolidine-1-carboxylate

HRID 306560노트

반응식

HRID 306560 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:19](=[O:20])[OH:21])[CH2:10][CH2:11][CH:12]1[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1.[NH2:22][c:23]1[c:24](-[c:33]2[cH:34][c:35]([O:39][c:40]3[cH:41][cH:42][cH:43][c:44]4[c:45]3[n:46][c:47]([NH:49][C:50]([CH3:51])=[O:52])[s:48]4)[n:36][cH:37][n:38]2)[cH:25][cH:26][c:27]([C:29]([F:30])([F:31])[F:32])[cH:28]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:19](=[O:20])[NH:22][c:23]2[c:24](-[c:33]3[cH:34][c:35]([O:39][c:40]4[cH:41][cH:42][cH:43][c:44]5[c:45]4[n:46][c:47]([NH:49][C:50]([CH3:51])=[O:52])[s:48]5)[n:36][cH:37][n:38]3)[cH:25][cH:26][c:27]([C:29]([F:30])([F:31])[F:32])[cH:28]2)[CH2:10][CH2:11][CH:12]1[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1

참가 물질

3

반응물 2

HCID 47125051-((Tert-butoxy)carbonyl)-5-phenylpyrrolidine-2-carboxylic acidHCID 21865046N-(4-(6-(2-Amino-4-(trifluoromethyl)phenyl)pyrimidin-4-yloxy)benzo[d]thiazol-2-yl)acetamide

생성물 1

HCID 72393471Tert-butyl 2-[[2-[6-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]pyrimidin-4-yl]-5-(trifluoromethyl)phenyl]carbamoyl]-5-phenylpyrrolidine-1-carboxylate

출처 및 근거

ORD 기록
ord-286afced7237477ab229a24d659165a0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

반응 노트

불러오는 중…