HRID85954

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID6340

Ethane, iodo-

C2H5I

HCID8028

Tetrahydrofuran

C4H8O

HCID3280088

未命名化合物

结构：CC(C)(C)OC(=O)N1C(C(=O)c2c[nH]c3ccccc23)CSC1c1cccnc1

HCID57091474

未命名化合物

PRODUCTS

生成物

结构：CCn1cc(C(=O)C2CSC(c3cccnc3)N2C(=O)OC(C)(C)C)c2ccccc21

HCID57191446

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a02c6daaf9784906a616750b5a00f4ea
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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