HRID1208279

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID140342

Methanethiol, trimethylsilyl-

C4H12SSi

HCID2758875

Trifluoromethanesulfonate

CF3O3S-

3 次

HCID4534583

未命名化合物

结构：COC(=O)C1CC(O)(c2ccc(-c3ccccc3)cc2)CN1C(=O)OCc1ccccc1

HCID66753132

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C1CC(SC[Si](C)(C)C)(c2ccc(-c3ccccc3)cc2)CN1C(=O)OCc1ccccc1

HCID67258628

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-817cd4f1e14249099af1dbf31e831f7a
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

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