HRID1563979

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID674

Dimethylamine

C2H7N

HCID8028

Tetrahydrofuran

C4H8O

HCID16682925

Aluminum, trimethyl-

C3H9Al

结构：CCOC(=O)c1csc(N2N=C(c3cc(F)ccc3F)SC2(CCCN=[N+]=[N-])c2ccccc2)n1

HCID86608779

未命名化合物

PRODUCTS

生成物

结构：CN(C)C(=O)c1csc(N2N=C(c3cc(F)ccc3F)SC2(CCCN=[N+]=[N-])c2ccccc2)n1

HCID86649371

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ad630f72030c4364b248e2c504f213df
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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