HRID100750

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID21897744

1-[3-(Propan-2-yl)-1,2,4-oxadiazol-5-yl]piperidin-4-ol

C10H17N3O2

HCID86637397

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1noc(N2CCC(Oc3ncnc4c3CCN4c3cc(F)c(Br)cc3F)CC2)n1

HCID58017046

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-abedf8e17400421c9de197630bc39eaf
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

[Br:18][c:19]1[cH:20][c:21]([F:36])[c:22]([N:26]2[CH2:27][CH2:28][c:29]3[c:30]2[n:31][cH:32][n:33][c:34]3[Cl:35])[cH:23][c:24]1[F:25].[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:1][CH:2]([CH3:3])[c:4]1[n:5][o:6][c:7]([N:9]2[CH2:10][CH2:11][CH:12]([OH:15])[CH2:13][CH2:14]2)[n:8]1.[H-:17].[Na+:16].[OH2:42]>>[CH3:1][CH:2]([CH3:3])[c:4]1[n:5][o:6][c:7]([N:9]2[CH2:10][CH2:11][CH:12]([O:15][c:34]3[c:29]4[c:30]([n:31][cH:32][n:33]3)[N:26]([c:22]3[c:21]([F:36])[cH:20][c:19]([Br:18])[c:24]([F:25])[cH:23]3)[CH2:27][CH2:28]4)[CH2:13][CH2:14]2)[n:8]1