HRID670256

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID12679

Hexamethylphosphoramide

C6H18N3OP

HCID103968

1,1'-(4-Iodobutane-1,1-diyl)bis(4-fluorobenzene)

C16H15F2I

HCID20484283

未命名化合物

PRODUCTS

生成物

结构：Cc1csc2ccc3[nH]c4c(c3c12)CN(CCCC(c1ccc(F)cc1)c1ccc(F)cc1)CC4

HCID20484301

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-23ecb0e5641f44e2af2643de6097a5e2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH3:18][N:19]([CH3:20])[P:21](=[O:22])([N:23]([CH3:24])[CH3:25])[N:26]([CH3:27])[CH3:28].[CH3:1][c:2]1[cH:3][s:4][c:5]2[c:6]1[c:7]1[c:8]3[c:9]([nH:10][c:11]1[cH:12][cH:13]2)[CH2:14][CH2:15][NH:16][CH2:17]3.[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[F:29][c:30]1[cH:31][cH:32][c:33]([CH:36]([CH2:37][CH2:38][CH2:39][I:40])[c:41]2[cH:42][cH:43][c:44]([F:47])[cH:45][cH:46]2)[cH:34][cH:35]1>>[CH3:1][c:2]1[cH:3][s:4][c:5]2[c:6]1[c:7]1[c:8]3[c:9]([nH:10][c:11]1[cH:12][cH:13]2)[CH2:14][CH2:15][N:16]([CH2:39][CH2:38][CH2:37][CH:36]([c:33]1[cH:32][cH:31][c:30]([F:29])[cH:35][cH:34]1)[c:41]1[cH:42][cH:43][c:44]([F:47])[cH:45][cH:46]1)[CH2:17]3