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Acetonitrile → Tert-butyl 2-(benzenesulfonamido)-3-[3-phenylmethoxy-4-[1,1,4-trioxo-5-(2-trimethylsilylethyl)-1,2,5-thiadiazolidin-2-yl]phenyl]propanoate

HRID 176787
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HRID 176787 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]([CH2:8][c:9]1[cH:10][c:11]([O:29][CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:12]([N:15]2[S:16](=[O:27])(=[O:28])[N:17]([CH2:21][CH2:22][Si:23]([CH3:24])([CH3:25])[CH3:26])[C:18](=[O:20])[CH2:19]2)[cH:13][cH:14]1)[NH2:37])=[O:38].[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:56][C:57]#[N:58].[c:46]1([S:52](=[O:53])(=[O:54])[Cl:55])[cH:47][cH:48][cH:49][cH:50][cH:51]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]([CH2:8][c:9]1[cH:10][c:11]([O:29][CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:12]([N:15]2[S:16](=[O:27])(=[O:28])[N:17]([CH2:21][CH2:22][Si:23]([CH3:24])([CH3:25])[CH3:26])[C:18](=[O:20])[CH2:19]2)[cH:13][cH:14]1)[NH:37][S:52]([c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1)(=[O:53])=[O:54])=[O:38]
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참가 물질

5

반응물 4

HCID 6342AcetonitrileHCID 7369Benzenesulfonyl chlorideHCID 8471TriethylamineHCID 68999781Tert-butyl 2-amino-3-[3-phenylmethoxy-4-[1,1,4-trioxo-5-(2-trimethylsilylethyl)-1,2,5-thiadiazolidin-2-yl]phenyl]propanoate

생성물 1

HCID 68842905Tert-butyl 2-(benzenesulfonamido)-3-[3-phenylmethoxy-4-[1,1,4-trioxo-5-(2-trimethylsilylethyl)-1,2,5-thiadiazolidin-2-yl]phenyl]propanoate

출처 및 근거

ORD 기록
ord-2502755565a343f7baded692a6241b07
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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