HRID2310246

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7937

2,6-Dimethylpyridine

C7H9N

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

反应SMILES：CC(C)(C)[Si](C)(C)OS(=O)(=O)C(F)(F)F

HCID123564

tert-Butyldimethylsilyl trifluoromethanesulphonate

C7H15F3O3SSi

反应SMILES：CCCc1c(Cc2ccc(-c3ccccc3C#N)cc2)c(=O)n(Cc2ccc(C(C)O)cc2)c2ncnn12

HCID67009294

未命名化合物

PRODUCTS

产物

反应SMILES：CCCc1c(Cc2ccc(-c3ccccc3C#N)cc2)c(=O)n(Cc2ccc(C(C)O[Si](C)(C)C(C)(C)C)cc2)c2ncnn12

HCID67009495

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-4c2af46462af47bc89d1985072530239
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

[CH3:67][CH2:68][O:69][C:70](=[O:71])[CH3:72].[F:52][C:53]([F:54])([F:55])[S:56]([O:57][Si:58]([CH3:59])([CH3:60])[C:61]([CH3:62])([CH3:63])[CH3:64])(=[O:65])=[O:66].[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1.[OH:1][CH:2]([CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH2:8][n:9]2[c:10]3[n:11]([c:12]([CH2:31][CH2:32][CH3:33])[c:13]([CH2:16][c:17]4[cH:18][cH:19][c:20](-[c:23]5[c:24]([C:29]#[N:30])[cH:25][cH:26][cH:27][cH:28]5)[cH:21][cH:22]4)[c:14]2=[O:15])[n:34][cH:35][n:36]3)[cH:37][cH:38]1.[n:39]1[c:40]([CH3:41])[cH:42][cH:43][cH:44][c:45]1[CH3:46]>>[O:1]([CH:2]([CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH2:8][n:9]2[c:10]3[n:11]([c:12]([CH2:31][CH2:32][CH3:33])[c:13]([CH2:16][c:17]4[cH:18][cH:19][c:20](-[c:23]5[c:24]([C:29]#[N:30])[cH:25][cH:26][cH:27][cH:28]5)[cH:21][cH:22]4)[c:14]2=[O:15])[n:34][cH:35][n:36]3)[cH:37][cH:38]1)[Si:58]([CH3:59])([CH3:60])[C:61]([CH3:62])([CH3:63])[CH3:64]