HRID100771

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID75555

未命名化合物

HCID354317

Methyl 5-hydroxynicotinate

C7H7NO3

HCID11551213

未命名化合物

PRODUCTS

产物

HCID11647803

Methyl 5-4-[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]butoxynicotinate

C23H20FN3O3S

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-b85ca4fdf1274beb99494461b49431a1
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

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