HRID307455

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID11205

Carbon tetrabromide

CBr4

HCID11776

Triphenylphosphine

C18H15P

结构：C[Si](C)(C)CCOCn1ccc2c(-c3cnn(C4(CC#N)CC(CO)C4)c3)ncnc21

HCID67017206

未命名化合物

PRODUCTS

生成物

结构：C[Si](C)(C)CCOCn1ccc2c(-c3cnn(C4(CC#N)CC(CBr)C4)c3)ncnc21

HCID67017217

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9c520c910cf440419911371634731c4a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:32]([Br:33])([Br:34])([Br:35])[Br:36].[Na+:60].[O-:56][C:57]([OH:58])=[O:59].[O:61]=[CH:62][N:63]([CH3:64])[CH3:65].[OH2:66].[OH:1][CH2:2][CH:3]1[CH2:4][C:5]([n:7]2[n:8][cH:9][c:10](-[c:12]3[c:13]4[c:14]([n:15][cH:16][n:17]3)[n:18]([CH2:21][O:22][CH2:23][CH2:24][Si:25]([CH3:26])([CH3:27])[CH3:28])[cH:19][cH:20]4)[cH:11]2)([CH2:29][C:30]#[N:31])[CH2:6]1.[c:37]1([P:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[CH2:2]([CH:3]1[CH2:4][C:5]([n:7]2[n:8][cH:9][c:10](-[c:12]3[c:13]4[c:14]([n:15][cH:16][n:17]3)[n:18]([CH2:21][O:22][CH2:23][CH2:24][Si:25]([CH3:26])([CH3:27])[CH3:28])[cH:19][cH:20]4)[cH:11]2)([CH2:29][C:30]#[N:31])[CH2:6]1)[Br:33]