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Sodium Ion → tert-Butyl ({4-fluoro-5-(2-fluoropyridin-3-yl)-1-[(5-fluoropyridin-2-yl)sulfonyl]-1H-pyrrol-3-yl}methyl)methylcarbamate

HRID 1215113
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HRID 1215113 반응식
[CH2:26]1[O:27][CH2:28][CH2:29][O:30][CH2:31][CH2:32][O:33][CH2:34][CH2:35][O:36][CH2:37][CH2:38][O:39][CH2:40]1.[F:3][c:4]1[c:5]([CH2:16][N:17]([C:18]([O:19][C:20]([CH3:21])([CH3:22])[CH3:23])=[O:24])[CH3:25])[cH:6][nH:7][c:8]1-[c:9]1[c:10]([F:15])[n:11][cH:12][cH:13][cH:14]1.[F:41][c:42]1[cH:43][cH:44][c:45]([S:48](=[O:49])(=[O:50])[F:51])[n:46][cH:47]1.[H-:1].[Na+:2].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[OH2:57]>>[F:3][c:4]1[c:5]([CH2:16][N:17]([C:18]([O:19][C:20]([CH3:21])([CH3:22])[CH3:23])=[O:24])[CH3:25])[cH:6][n:7]([S:48]([c:45]2[cH:44][cH:43][c:42]([F:41])[cH:47][n:46]2)(=[O:49])=[O:50])[c:8]1-[c:9]1[c:10]([F:15])[n:11][cH:12][cH:13][cH:14]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 923Sodium IonHCID 962WaterHCID 8028TetrahydrofuranHCID 3633615-Crown-5HCID 166653HydrideHCID 545947785-Fluoropyridine-2-sulfonyl fluorideHCID 67176761tert-butyl {[4-fluoro-5-(2-fluoropyridin-3-yl)-1H-pyrrol-3-yl]methyl}methylcarbamate

생성물

1
HCID 67176681tert-Butyl ({4-fluoro-5-(2-fluoropyridin-3-yl)-1-[(5-fluoropyridin-2-yl)sulfonyl]-1H-pyrrol-3-yl}methyl)methylcarbamate

출처 및 근거

ORD 기록
ord-7f5a2b2d04ce4726baa1a5446b6d99c0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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