HRID1227844

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID22136507

未命名化合物

结构：C[Si](C)(C)CCOCn1nc(C=Nn2cccc2)c2ccc(Nc3ccccc3C(=O)O)cc21

HCID69353167

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)[Si](C)(C)OCC#CCNC(=O)c1ccccc1Nc1ccc2c(C=Nn3cccc3)nn(COCC[Si](C)(C)C)c2c1

HCID69353748

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-852f2c4c75014f678850aa0e6697bb83
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:35]([CH3:36])([CH3:37])([CH3:38])[Si:39]([O:40][CH2:41][C:42]#[C:43][CH2:44][NH2:45])([CH3:46])[CH3:47].[n:1]1([N:6]=[CH:7][c:8]2[n:9][n:10]([CH2:27][O:28][CH2:29][CH2:30][Si:31]([CH3:32])([CH3:33])[CH3:34])[c:11]3[cH:12][c:13]([NH:17][c:18]4[c:19]([C:20](=[O:21])[OH:22])[cH:23][cH:24][cH:25][cH:26]4)[cH:14][cH:15][c:16]23)[cH:2][cH:3][cH:4][cH:5]1>>[n:1]1([N:6]=[CH:7][c:8]2[n:9][n:10]([CH2:27][O:28][CH2:29][CH2:30][Si:31]([CH3:32])([CH3:33])[CH3:34])[c:11]3[cH:12][c:13]([NH:17][c:18]4[c:19]([C:20](=[O:22])[NH:45][CH2:44][C:43]#[C:42][CH2:41][O:40][Si:39]([C:35]([CH3:36])([CH3:37])[CH3:38])([CH3:46])[CH3:47])[cH:23][cH:24][cH:25][cH:26]4)[cH:14][cH:15][c:16]23)[cH:2][cH:3][cH:4][cH:5]1