Ethanol → 3-[2-(2-Ethylbenzoimidazol-1-yl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-ylmethyl]azetidine-1-carboxylic acid tert-butyl ester

반응식

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

참가 물질

반응물 2

HCID 702Ethanol

HCID 596056083-[2-(2-Ethylbenzoimidazol-1-yl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-ylmethylene]azetidine-1-carboxylic acid tert-butyl ester

생성물 1

HCID 596060703-[2-(2-Ethylbenzoimidazol-1-yl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-ylmethyl]azetidine-1-carboxylic acid tert-butyl ester

출처 및 근거

ORD 기록: ord-ad5a9af4073a489aa485e03cdd480258
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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