HRID1241106

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

HCID2736229

1-(2-dimethylaminoethyl)piperazine

C8H19N3

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

结构：C[Si](C)(C)CCOCn1nc(I)c2cc(-c3cccc(C(=O)O)c3)cnc21

HCID59836117

未命名化合物

PRODUCTS

生成物

结构：CN(C)CCN1CCN(C(=O)c2cccc(-c3cnc4c(c3)c(I)nn4COCC[Si](C)(C)C)c2)CC1

HCID59836010

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-91573dd1f49b48a380ad9826b726a6e3
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

[CH2:63]([N:64]([CH2:65][CH3:66])[CH2:67][CH3:68])[CH3:69].[CH3:28][N:29]([CH2:30][CH2:31][N:32]1[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]1)[CH3:38].[I:1][c:2]1[n:3][n:4]([CH2:20][O:21][CH2:22][CH2:23][Si:24]([CH3:25])([CH3:26])[CH3:27])[c:5]2[n:6][cH:7][c:8](-[c:11]3[cH:12][c:13]([C:14](=[O:15])[OH:16])[cH:17][cH:18][cH:19]3)[cH:9][c:10]12.[O:70]=[CH:71][N:72]([CH3:73])[CH3:74].[OH2:75].[P-:39]([F:40])([F:41])([F:42])([F:43])([F:44])[F:45].[n:46]1([O:47][C:48]([N:49]([CH3:50])[CH3:51])=[N+:52]([CH3:53])[CH3:54])[c:55]2[n:56][cH:57][cH:58][cH:59][c:60]2[n:61][n:62]1>>[I:1][c:2]1[n:3][n:4]([CH2:20][O:21][CH2:22][CH2:23][Si:24]([CH3:25])([CH3:26])[CH3:27])[c:5]2[n:6][cH:7][c:8](-[c:11]3[cH:12][c:13]([C:14](=[O:16])[N:35]4[CH2:34][CH2:33][N:32]([CH2:31][CH2:30][N:29]([CH3:28])[CH3:38])[CH2:37][CH2:36]4)[cH:17][cH:18][cH:19]3)[cH:9][c:10]12