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Tetrahydrofuran → Methyl 5-[2-(4-methylimidazol-1-yl)-1-(thiazol-2-yl)ethoxy]-2-(4-fluorophenethyl)benzoate

HRID 1203894
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HRID 1203894 반응식
[CH2:66]1[O:67][CH2:68][CH2:69][CH2:70]1.[CH3:1][c:2]1[n:3][cH:4][n:5]([CH2:7][CH:8]([OH:9])[c:10]2[s:11][cH:12][cH:13][n:14]2)[cH:6]1.[F:15][c:16]1[cH:17][cH:18][c:19]([CH2:20][CH2:21][c:22]2[c:23]([C:24](=[O:25])[O:26][CH3:27])[cH:28][c:29]([OH:32])[cH:30][cH:31]2)[cH:33][cH:34]1.[O:54]=[C:55]([O:56][CH2:57][CH3:58])[N:59]=[N:60][C:61]([O:62][CH2:63][CH3:64])=[O:65].[c:35]1([P:36]([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[cH:49][cH:50][cH:51][cH:52][cH:53]1>>[CH3:1][c:2]1[n:3][cH:4][n:5]([CH2:7][CH:8]([O:9][c:29]2[cH:28][c:23]([C:24](=[O:25])[O:26][CH3:27])[c:22]([CH2:21][CH2:20][c:19]3[cH:18][cH:17][c:16]([F:15])[cH:34][cH:33]3)[cH:31][cH:30]2)[c:10]2[s:11][cH:12][cH:13][n:14]2)[cH:6]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 220568ethyl N-ethoxycarbonyliminocarbamateHCID 183244462-(4-Methylimidazol-1-yl)-1-(thiazol-2-yl)ethanolHCID 18324453Methyl 2-(4-fluorophenethyl)-5-hydroxybenzoate

생성물 1

HCID 18324416
Methyl 5-[2-(4-methylimidazol-1-yl)-1-(thiazol-2-yl)ethoxy]-2-(4-fluorophenethyl)benzoate

출처 및 근거

ORD 기록
ord-60664fc0f0ae454196ed7b7c89ade760
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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