HRID693800

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID21897744

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

C10H17N3O2

结构：CS(=O)(=O)c1ccc(N2CCc3c(Cl)ncnc32)c(F)c1

HCID42636822

4-Chloro-7-[2-fluoro-4-(methanesulfonyl)phenyl]-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine

C13H11ClFN3O2S

PRODUCTS

生成物

结构：CC(C)c1noc(N2CCC(Oc3ncnc4c3CCN4c3ccc(S(C)(=O)=O)cc3F)CC2)n1

HCID58017032

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ced48dc8b5834e61b53291bd426dc41d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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