Iodoacetamide → 2-[[1-[2-(6-tert-butyl-4-ethoxy-3-pyridinyl)-4,5-bis(4-chlorophenyl)-4,5-dimethylimidazole-1-carbonyl]piperidin-4-yl]amino]acetamide

HRID 112501

반응식

HRID 112501 반응식
[I:44][CH2:45][C:46](=[O:47])[NH2:48].[NH2:1][CH:2]1[CH2:3][CH2:4][N:5]([C:8](=[O:9])[N:10]2[C:11]([c:31]3[cH:32][n:33][c:34]([C:40]([CH3:41])([CH3:42])[CH3:43])[cH:35][c:36]3[O:37][CH2:38][CH3:39])=[N:12][C:13]([CH3:23])([c:24]3[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]3)[C:14]2([CH3:15])[c:16]2[cH:17][cH:18][c:19]([Cl:22])[cH:20][cH:21]2)[CH2:6][CH2:7]1>>[NH:1]([CH:2]1[CH2:3][CH2:4][N:5]([C:8](=[O:9])[N:10]2[C:11]([c:31]3[cH:32][n:33][c:34]([C:40]([CH3:41])([CH3:42])[CH3:43])[cH:35][c:36]3[O:37][CH2:38][CH3:39])=[N:12][C:13]([CH3:23])([c:24]3[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]3)[C:14]2([CH3:15])[c:16]2[cH:17][cH:18][c:19]([Cl:22])[cH:20][cH:21]2)[CH2:6][CH2:7]1)[CH2:45][C:46](=[O:47])[NH2:48]

참가 물질

3

반응물 2

HCID 3727IodoacetamideHCID 178466405(4-aminopiperidin-1-yl)-[2-(6-tert-butyl-4-ethoxy-3-pyridinyl)-4,5-bis(4-chlorophenyl)-4,5-dimethylimidazol-1-yl]methanone

생성물 1

HCID 1784664082-[[1-[2-(6-tert-butyl-4-ethoxy-3-pyridinyl)-4,5-bis(4-chlorophenyl)-4,5-dimethylimidazole-1-carbonyl]piperidin-4-yl]amino]acetamide

출처 및 근거

ORD 기록
ord-bb556fe0b59d45f0938d81f06db3e486
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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