HRID97377

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)(C)C(NC(=O)c1cn(COCC[Si](C)(C)C)c2ncc(C3CC3)nc12)C(=O)N1CCCC1

HCID67386350

未命名化合物

结构：Cn1cnc(-c2cnc3c(n2)c(C(=O)NC(C(=O)N2CCC(C#N)CC2)C(C)(C)C)cn3COCC[Si](C)(C)C)c1

HCID178481261

未命名化合物

PRODUCTS

生成物

结构：Cn1cnc(-c2cnc3[nH]cc(C(=O)NC(C(=O)N4CCC(C#N)CC4)C(C)(C)C)c3n2)c1

HCID76786432

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-de3534d668a54d5e8df51ebc78090b19
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:1](#[N:2])[CH:3]1[CH2:4][CH2:5][N:6]([C:9](=[O:10])[CH:11]([C:12]([CH3:13])([CH3:14])[CH3:15])[NH:16][C:17](=[O:18])[c:19]2[cH:20][n:21]([CH2:34][O:35][CH2:36][CH2:37][Si:38]([CH3:39])([CH3:40])[CH3:41])[c:22]3[n:23][cH:24][c:25](-[c:28]4[n:29][cH:30][n:31]([CH3:33])[cH:32]4)[n:26][c:27]23)[CH2:7][CH2:8]1.[CH:42]1([c:43]2[n:44][c:45]3[c:46]([C:47]([NH:48][CH:49]([C:50]([CH3:51])([CH3:52])[CH3:53])[C:54](=[O:55])[N:56]4[CH2:57][CH2:58][CH2:59][CH2:60]4)=[O:61])[cH:62][n:63]([CH2:64][O:65][CH2:66][CH2:67][Si:68]([CH3:69])([CH3:70])[CH3:71])[c:72]3[n:73][cH:74]2)[CH2:75][CH2:76]1>>[C:1](#[N:2])[CH:3]1[CH2:4][CH2:5][N:6]([C:9](=[O:10])[CH:11]([C:12]([CH3:13])([CH3:14])[CH3:15])[NH:16][C:17](=[O:18])[c:19]2[cH:20][nH:21][c:22]3[n:23][cH:24][c:25](-[c:28]4[n:29][cH:30][n:31]([CH3:33])[cH:32]4)[n:26][c:27]23)[CH2:7][CH2:8]1