HRID178266

反应详情

EQUATION

反应方程式

REACTANTS

反应物

反应SMILES：COc1cccc(-n2c(C(C)Nc3ncnc4c3ncn4COCC[Si](C)(C)C)nc3cccc(C)c3c2=O)c1

HCID66664053

未命名化合物

反应SMILES：Cc1cccc2nc(C(C)Nc3ncnc4[nH]cnc34)n(-c3cccc(O)c3)c(=O)c12

HCID178423955

未命名化合物

PRODUCTS

产物

反应SMILES：COc1cccc(-n2c(C(C)Nc3ncnc4[nH]cnc34)nc3cccc(C)c3c2=O)c1

HCID178490792

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-feb4dc97511f42048dda70d3f1d44b52
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

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