HRID310656

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

反应SMILES：Cc1cccc2nc(C(C)Nc3ncnc4c3ncn4COCC[Si](C)(C)C)n(-c3cccc(C(N)=O)c3)c(=O)c12

HCID66663949

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

HCID178423954

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-0d786d7fc36a403fb18034f7822c7e38
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

[CH3:1][c:2]1[c:3]2[c:4](=[O:41])[n:5](-[c:32]3[cH:33][c:34]([C:35](=[O:36])[NH2:37])[cH:38][cH:39][cH:40]3)[c:6]([CH:12]([CH3:13])[NH:14][c:15]3[c:16]4[n:17][cH:18][n:19]([CH2:24][O:25][CH2:26][CH2:27][Si:28]([CH3:29])([CH3:30])[CH3:31])[c:20]4[n:21][cH:22][n:23]3)[n:7][c:8]2[cH:9][cH:10][cH:11]1.[CH3:73][OH:74].[OH:42][c:43]1[cH:44][c:45](-[n:46]2[c:47](=[O:48])[c:49]3[c:50]([cH:51][cH:52][cH:53][c:54]3[CH3:55])[n:56][c:57]2[CH:58]([NH:59][c:60]2[n:61][cH:62][n:63][c:64]3[c:65]2[n:66][cH:67][nH:68]3)[CH3:69])[cH:70][cH:71][cH:72]1>>[CH3:1][c:2]1[c:3]2[c:4](=[O:41])[n:5](-[c:32]3[cH:33][c:34]([C:35](=[O:36])[NH2:37])[cH:38][cH:39][cH:40]3)[c:6]([CH:12]([CH3:13])[NH:14][c:15]3[c:16]4[n:17][cH:18][nH:19][c:20]4[n:21][cH:22][n:23]3)[n:7][c:8]2[cH:9][cH:10][cH:11]1