HRID318257

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID13838

Hexamethyldisilazane

C6H19NSi2

HCID259252

N-(4-amino-2-chlorophenyl)acetamide

C8H9ClN2O

HCID3028194

Lithium

HCID59548468

未命名化合物

PRODUCTS

生成物

结构：CC(=O)Nc1ccc(Nc2ncccc2-c2nc(C)nc3c2ncn3C2CCCCO2)cc1Cl

HCID66600017

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3cc95c7ee2244fa48fca163c9df7b5e4
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

[CH2:46]1[O:47][CH2:48][CH2:49][CH2:50]1.[CH3:36][Si:37]([NH:38][Si:39]([CH3:40])([CH3:41])[CH3:42])([CH3:43])[CH3:44].[F:1][c:2]1[n:3][cH:4][cH:5][cH:6][c:7]1-[c:8]1[c:9]2[n:10][cH:11][n:12]([CH:18]3[O:19][CH2:20][CH2:21][CH2:22][CH2:23]3)[c:13]2[n:14][c:15]([CH3:17])[n:16]1.[Li:45].[NH2:24][c:25]1[cH:26][c:27]([Cl:35])[c:28]([NH:31][C:32]([CH3:33])=[O:34])[cH:29][cH:30]1.[Na+:55].[O-:51][C:52]([OH:53])=[O:54]>>[c:2]1([NH:24][c:25]2[cH:26][c:27]([Cl:35])[c:28]([NH:31][C:32]([CH3:33])=[O:34])[cH:29][cH:30]2)[n:3][cH:4][cH:5][cH:6][c:7]1-[c:8]1[c:9]2[n:10][cH:11][n:12]([CH:18]3[O:19][CH2:20][CH2:21][CH2:22][CH2:23]3)[c:13]2[n:14][c:15]([CH3:17])[n:16]1