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Water → Methyl 5-[4-(difluoromethoxy)phenyl]-1-[(1,1-dioxidothiomorpholin-4-yl)carbonyl]piperidine-3-carboxylate

HRID 953618
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반응식

HRID 953618 반응식
[CH3:51][N:52]1[CH2:53][CH2:54][CH2:55][C:56]1=[O:57].[CH3:58][CH2:59][O:60][C:61](=[O:62])[CH3:63].[CH:21]([N:22]([CH2:23][CH3:24])[CH:25]([CH3:26])[CH3:27])([CH3:28])[CH3:29].[F:1][CH:2]([O:3][c:4]1[cH:5][cH:6][c:7]([CH:10]2[CH2:11][CH:12]([C:16](=[O:17])[O:18][CH3:19])[CH2:13][NH:14][CH2:15]2)[cH:8][cH:9]1)[F:20].[OH2:50].[S:30]1(=[O:48])(=[O:49])[CH2:31][CH2:32][N:33]([C:36](=[O:37])[O:38][c:39]2[cH:40][cH:41][c:42]([N+:43]([O-:44])=[O:45])[cH:46][cH:47]2)[CH2:34][CH2:35]1>>[F:1][CH:2]([O:3][c:4]1[cH:5][cH:6][c:7]([CH:10]2[CH2:11][CH:12]([C:16](=[O:17])[O:18][CH3:19])[CH2:13][N:14]([C:36]([N:33]3[CH2:32][CH2:31][S:30](=[O:48])(=[O:49])[CH2:35][CH2:34]3)=[O:37])[CH2:15]2)[cH:8][cH:9]1)[F:20]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 962WaterHCID 8857Ethyl AcetateHCID 13387N-methyl-2-pyrrolidoneHCID 81531DiisopropylethylamineHCID 581165414-Nitrophenyl thiomorpholine-4-carboxylate 1,1-dioxideHCID 58116573Methyl 5-[4-(difluoromethoxy)phenyl]piperidine-3-carboxylate

생성물 1

HCID 58116465
Methyl 5-[4-(difluoromethoxy)phenyl]-1-[(1,1-dioxidothiomorpholin-4-yl)carbonyl]piperidine-3-carboxylate

출처 및 근거

ORD 기록
ord-ec09ff38518a42d7b6cca0bcd98fca40
출처 데이터셋
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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