HRID168259

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

结构：CC(C)(C)OC(=O)N(Cc1ccc(CNC2(C)CCCc3cccnc32)cc1)Cc1ccccn1

HCID22018645

未命名化合物

HCID22018706

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N(Cc1ccc(CN(Cc2nc3ccccc3n2COCC[Si](C)(C)C)C2(C)CCCc3cccnc32)cc1)Cc1ccccn1

HCID22018754

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-613d1d9014784b00851ce9cf014c8d30
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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