HRID2314468

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)(C)[Si](C)(C)OCC1(COS(C)(=O)=O)CC1

HCID59000927

Cyclopropanemethanol, 1-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]-, 1-methanesulfonate

C12H26O4SSi

结构：CC(C)(C)OC(=O)N1CCCC(CSc2c[nH]c(=O)c3ccc(Br)cc23)C1

HCID178451886

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCCC(CSc2cn(CC3(CO[Si](C)(C)C(C)(C)C)CC3)c(=O)c3ccc(Br)cc23)C1

HCID178451885

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8f929a09afb7428c8fbc7cd92d6edf45
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]2[c:5]([S:13][CH2:14][CH:15]3[CH2:16][N:17]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:18][CH2:19][CH2:20]3)[cH:6][nH:7][c:8](=[O:12])[c:9]2[cH:10][cH:11]1.[CH3:28][S:29]([O:30][CH2:33][C:34]1([CH2:37][O:38][Si:39]([CH3:40])([CH3:41])[C:42]([CH3:43])([CH3:44])[CH3:45])[CH2:35][CH2:36]1)(=[O:31])=[O:32]>>[Br:1][c:2]1[cH:3][c:4]2[c:5]([S:13][CH2:14][CH:15]3[CH2:16][N:17]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:18][CH2:19][CH2:20]3)[cH:6][n:7]([CH2:33][C:34]3([CH2:37][O:38][Si:39]([CH3:40])([CH3:41])[C:42]([CH3:43])([CH3:44])[CH3:45])[CH2:35][CH2:36]3)[c:8](=[O:12])[c:9]2[cH:10][cH:11]1