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Acetonitrile → 1-(3,4,5-Trimethoxybenzoyl)-3-(2-(4-(1-(2-(1H-imidazol-1-yl)ethyl)-1H-benzimidazol-2-yl)[1,4]diazepan-1-yl)ethyl)-3-phenylpyrrolidine

HRID 937636
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인쇄 미리보기

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HRID 937636 반응식
[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][C:10]([CH2:13][CH2:14][O:15][S:16]([CH3:17])(=[O:18])=[O:19])([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:11][CH2:12]2)[cH:26][c:27]([O:31][CH3:32])[c:28]1[O:29][CH3:30].[CH3:66][C:67]#[N:68].[CH:57]([N:58]([CH2:59][CH3:60])[CH:61]([CH3:62])[CH3:63])([CH3:64])[CH3:65].[Cl:69][CH2:70][Cl:71].[IH:33].[n:34]1([CH2:39][CH2:40][n:41]2[c:42]([N:50]3[CH2:51][CH2:52][NH:53][CH2:54][CH2:55][CH2:56]3)[n:43][c:44]3[c:45]2[cH:46][cH:47][cH:48][cH:49]3)[cH:35][n:36][cH:37][cH:38]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][C:10]([CH2:13][CH2:14][N:53]3[CH2:52][CH2:51][N:50]([c:42]4[n:41]([CH2:40][CH2:39][n:34]5[cH:35][n:36][cH:37][cH:38]5)[c:45]5[c:44]([n:43]4)[cH:49][cH:48][cH:47][cH:46]5)[CH2:56][CH2:55][CH2:54]3)([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:11][CH2:12]2)[cH:26][c:27]([O:31][CH3:32])[c:28]1[O:29][CH3:30]
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반응물 6

HCID 6342AcetonitrileHCID 6344DichloromethaneHCID 24841Hydrogen iodideHCID 81531DiisopropylethylamineHCID 184646303,4,5-Trimethoxybenzoyl-3-phenyl-3-(2-methanesulfonyloxyethyl)pyrrolidineHCID 184646922-(1,4-Diazepan-1-yl)-1-(2-imidazol-1-ylethyl)benzimidazole

생성물 1

HCID 18464586
1-(3,4,5-Trimethoxybenzoyl)-3-(2-(4-(1-(2-(1H-imidazol-1-yl)ethyl)-1H-benzimidazol-2-yl)[1,4]diazepan-1-yl)ethyl)-3-phenylpyrrolidine

출처 및 근거

ORD 기록
ord-53d526580c05443a970e3af9d7184118
출처 데이터셋
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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