HRID2157967

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8900

Heptane

C7H16

HCID12684258

5-Bromopyridine-3-sulfonamide

C5H5BrN2O2S

结构：CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[c]1cn(-c2cc(C(F)(F)F)cc(-c3ccc(C(F)(F)F)cc3)n2)cn1

HCID57468833

未命名化合物

PRODUCTS

生成物

结构：NS(=O)(=O)c1cncc(-c2cn(-c3cc(C(F)(F)F)cc(-c4ccc(C(F)(F)F)cc4)n3)cn2)c1

HCID57469032

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-55c97824006847f9942514b45f3a229f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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