HRID1153247

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID6395

Methanesulfonic acid

CH4O3S

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

结构：COCC(C)Oc1cc(O[Si](C(C)C)(C(C)C)C(C)C)cc(-c2ccc(C(=O)NCC(C)O)[nH]2)c1

HCID178495532

未命名化合物

PRODUCTS

生成物

结构：COCC(C)Oc1cc(O[Si](C(C)C)(C(C)C)C(C)C)cc(-c2ccc(C3=NCC(C)O3)[nH]2)c1

HCID178495526

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-87bea1f4c8444c0b9ec6549045e31167
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:36][S:37](=[O:38])(=[O:39])[OH:40].[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[Cl-:48].[NH4+:49].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[OH:1][CH:2]([CH2:3][NH:4][C:5](=[O:6])[c:7]1[nH:8][c:9](-[c:12]2[cH:13][c:14]([O:29][CH:30]([CH2:31][O:32][CH3:33])[CH3:34])[cH:15][c:16]([O:18][Si:19]([CH:20]([CH3:21])[CH3:22])([CH:23]([CH3:24])[CH3:25])[CH:26]([CH3:27])[CH3:28])[cH:17]2)[cH:10][cH:11]1)[CH3:35]>>[O:1]1[CH:2]([CH3:35])[CH2:3][N:4]=[C:5]1[c:7]1[nH:8][c:9](-[c:12]2[cH:13][c:14]([O:29][CH:30]([CH2:31][O:32][CH3:33])[CH3:34])[cH:15][c:16]([O:18][Si:19]([CH:20]([CH3:21])[CH3:22])([CH:23]([CH3:24])[CH3:25])[CH:26]([CH3:27])[CH3:28])[cH:17]2)[cH:10][cH:11]1