HRID1229734

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID17819518

未命名化合物

结构：CC(C)(c1cc(NC(=O)Oc2ccccc2)no1)C(F)(F)F

HCID66877298

未命名化合物

HCID86653525

未命名化合物

PRODUCTS

生成物

结构：COc1cc2ncnc(Oc3cccc(NC(=O)Nc4cc(C(C)(C)C(F)(F)F)on4)c3F)c2cc1OC

HCID58267789

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-72ac8ec124204d1b845a9fda60dbc684
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:62]1[O:63][CH2:64][CH2:65][CH2:66]1.[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[c:17]([F:23])[c:18]([NH2:19])[cH:20][cH:21][cH:22]3)[n:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:67][N:68]([CH3:69])[c:70]1[cH:71][cH:72][n:73][cH:74][cH:75]1.[F:24][C:25]([C:26]([CH3:27])([CH3:28])[c:29]1[cH:30][c:31]([NH:34][C:35]([O:36][c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)=[O:37])[n:32][o:33]1)([F:44])[F:45].[F:46][C:47]([F:48])([F:49])[C:50]([c:51]1[o:52][n:53][c:54]([NH:55][C:56](=[O:57])[O-:58])[cH:59]1)([CH3:60])[CH3:61]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[c:17]([F:23])[c:18]([NH:19][C:35]([NH:34][c:31]4[cH:30][c:29]([C:26]([C:25]([F:24])([F:44])[F:45])([CH3:27])[CH3:28])[o:33][n:32]4)=[O:36])[cH:20][cH:21][cH:22]3)[n:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]