HRID213178

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

结构：CC(C)[Si](C(C)C)(C(C)C)n1cc(C=O)c2cccnc21

HCID49758965

未命名化合物

HCID59593371

未命名化合物

HCID178418306

未命名化合物

PRODUCTS

生成物

结构：CC(C)[Si](C(C)C)(C(C)C)n1cc(C(O)c2ccc(C(=O)Nc3ccc(Cl)cc3)nc2)c2cccnc21

HCID59593348

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-36ac645261e6405fb25aee9a51654a1b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:18]([Li:19])([CH3:20])([CH3:21])[CH3:22].[CH:23]([CH3:24])([CH3:25])[Si:26]([n:27]1[cH:28][c:29]([CH:36]=[O:37])[c:30]2[c:31]1[n:32][cH:33][cH:34][cH:35]2)([CH:38]([CH3:39])[CH3:40])[CH:41]([CH3:42])[CH3:43].[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9](=[O:10])[c:11]2[n:12][cH:13][c:14]([Br:17])[cH:15][cH:16]2)[cH:6][cH:7]1.[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[OH2:44]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9](=[O:10])[c:11]2[n:12][cH:13][c:14]([CH:36]([c:29]3[cH:28][n:27]([Si:26]([CH:23]([CH3:24])[CH3:25])([CH:38]([CH3:39])[CH3:40])[CH:41]([CH3:42])[CH3:43])[c:31]4[c:30]3[cH:35][cH:34][cH:33][n:32]4)[OH:37])[cH:15][cH:16]2)[cH:6][cH:7]1