HRID2327931

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID16028

Tetrabutylammonium

C16H36N+

HCID28179

Fluoride

F-

HCID552549

(Trifluoromethyl)trimethylsilane

C4H9F3Si

反应SMILES：Cn1cc2ccc(NC(=O)c3ccccc3NCc3ccnc(NC(=O)N4CCC(=O)CC4)c3)cc2n1

HCID57798921

未命名化合物

PRODUCTS

产物

反应SMILES：Cn1cc2ccc(NC(=O)c3ccccc3NCc3ccnc(NC(=O)N4CCC(O)(C(F)(F)F)CC4)c3)cc2n1

HCID11534251

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-21f2d0366b1747d098dac5a5d9397fae
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应SMILES

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