HRID2321758

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID643502

n-boc-4-hydroxypiperidine

C10H19NO3

反应SMILES：CS(=O)(=O)c1ccc(-n2ncc3c(Cl)ncnc32)cc1

HCID21897447

4-Chloro-1-[4-(methanesulfonyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidine

C12H9ClN4O2S

HCID178478424

未命名化合物

PRODUCTS

产物

反应SMILES：CC(C)(C)OC(=O)N1CCC(Oc2ncnc3c2cnn3-c2ccc(S(C)(=O)=O)cc2)CC1

HCID11282871

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-bd5831fed5ad4217a3ad745cd70fab33
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

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