HRID1543612

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

HCID352904

2-methoxypyrimidin-5-amine

C5H7N3O

HCID3280088

未命名化合物

结构：COc1ccc(CN(Cc2ccc(OC)cc2)c2nc(C)nc(-c3cc(CN4CCN(C(=O)OC(C)(C)C)CC4)cnc3F)n2)cc1

HCID60156087

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(CN(Cc2ccc(OC)cc2)c2nc(C)nc(-c3cc(CN4CCN(C(=O)OC(C)(C)C)CC4)cnc3Nc3cnc(OC)nc3)n2)cc1

HCID59548319

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2d942cbbb6514c9eb06c4aaf1232df8a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([c:9]2[n:10][c:11](-[c:16]3[cH:17][c:18]([CH2:23][N:24]4[CH2:25][CH2:26][N:27]([C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])[CH2:28][CH2:29]4)[cH:19][n:20][c:21]3[F:22])[n:12][c:13]([CH3:15])[n:14]2)[CH2:37][c:38]2[cH:39][cH:40][c:41]([O:44][CH3:45])[cH:42][cH:43]2)[cH:46][cH:47]1.[CH3:48][O:49][c:50]1[n:51][cH:52][c:53]([NH2:56])[cH:54][n:55]1.[CH3:62][Si:63]([N-:64][Si:65]([CH3:66])([CH3:67])[CH3:68])([CH3:69])[CH3:70].[Li+:71].[O:57]1[CH2:58][CH2:59][CH2:60][CH2:61]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([c:9]2[n:10][c:11](-[c:16]3[cH:17][c:18]([CH2:23][N:24]4[CH2:25][CH2:26][N:27]([C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])[CH2:28][CH2:29]4)[cH:19][n:20][c:21]3[NH:56][c:53]3[cH:52][n:51][c:50]([O:49][CH3:48])[n:55][cH:54]3)[n:12][c:13]([CH3:15])[n:14]2)[CH2:37][c:38]2[cH:39][cH:40][c:41]([O:44][CH3:45])[cH:42][cH:43]2)[cH:46][cH:47]1