HRID672576

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID8028

Tetrahydrofuran

C4H8O

HCID4574913

未命名化合物

结构：Cn1nnc(NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1

HCID23073221

N-{[3,5-Bis(trifluoromethyl)phenyl]methyl}-2-methyl-2H-tetrazol-5-amine

C11H9F6N5

HCID58968725

未命名化合物

PRODUCTS

生成物

结构：COC1(c2ccc(C(F)(F)F)cc2CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2nnn(C)n2)CCCCC1

HCID58968714

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bae3742a7f664d39b2f0a49d5a4bec7f
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

[Br:29][CH2:30][c:31]1[c:32]([C:41]2([O:47][CH3:48])[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]2)[cH:33][cH:34][c:35]([C:37]([F:38])([F:39])[F:40])[cH:36]1.[CH3:23][C:24]([CH3:25])([O-:26])[CH3:27].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][NH:7][c:8]2[n:9][n:10][n:11]([CH3:13])[n:12]2)[cH:14][c:15]([C:17]([F:18])([F:19])[F:20])[cH:16]1)([F:21])[F:22].[K+:28].[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][n:10][n:11]([CH3:13])[n:12]2)[CH2:30][c:31]2[c:32]([C:41]3([O:47][CH3:48])[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]3)[cH:33][cH:34][c:35]([C:37]([F:38])([F:39])[F:40])[cH:36]2)[cH:14][c:15]([C:17]([F:18])([F:19])[F:20])[cH:16]1)([F:21])[F:22]