HRID2138864

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID67184

1-Bromopyrrolidine-2,5-dione

C4H4BrNO2

结构：CC(C)(C)OC(=O)N1CCC(Oc2cc(N(COCC[Si](C)(C)C)COCC[Si](C)(C)C)n3ncc(-c4ccc(-c5ccccc5)nc4)c3n2)CC1

HCID66733519

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(Oc2nc3c(-c4ccc(-c5ccccc5)nc4)cnn3c(N(COCC[Si](C)(C)C)COCC[Si](C)(C)C)c2Br)CC1

HCID66733399

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a9936e2d19f24035a46526eee2315959
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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