Pyrrolidine-2-carboxamide → 1-[6-(4-methylsulfonylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]pyrrolidine-2-carboxamide

반응식

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

참가 물질

반응물 2

HCID 550774Pyrrolidine-2-carboxamide

HCID 231451405-(2-Ethoxycarbonyl-phenoxy)-6-(4-methanesulfonyl-phenoxy)-2-pyridin-2-yl-1H-benzimidazole

생성물 1

HCID 231452821-[6-(4-methylsulfonylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]pyrrolidine-2-carboxamide

출처 및 근거

ORD 기록: ord-9e6dff2fffc7457d9f8fb53a6e4843cf
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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