HRID945092

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

HCID556565

2,2,2-Trifluoroethyl methanesulfonate

C3H5F3O3S

结构：CCS(=O)(=O)N1CCN(C(=O)c2cc3cc(OC4CCN(C(C)C)CC4)c(Br)cc3[nH]2)CC1

HCID24958567

未命名化合物

PRODUCTS

生成物

结构：CCS(=O)(=O)N1CCN(C(=O)c2cc3cc(OC4CCN(C(C)C)CC4)c(Br)cc3n2CC(F)(F)F)CC1

HCID68565359

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-486b9cc5753e4c7a95ed3f9869cea01f
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br:1][c:2]1[c:3]([O:24][CH:25]2[CH2:26][CH2:27][N:28]([CH:31]([CH3:32])[CH3:33])[CH2:29][CH2:30]2)[cH:4][c:5]2[cH:6][c:7]([C:11](=[O:12])[N:13]3[CH2:14][CH2:15][N:16]([S:19](=[O:20])(=[O:21])[CH2:22][CH3:23])[CH2:17][CH2:18]3)[nH:8][c:9]2[cH:10]1.[CH3:36][S:37]([O:38][CH2:41][C:42]([F:43])([F:44])[F:45])(=[O:39])=[O:40].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[H-:34].[Na+:35].[OH2:46]>>[Br:1][c:2]1[c:3]([O:24][CH:25]2[CH2:26][CH2:27][N:28]([CH:31]([CH3:32])[CH3:33])[CH2:29][CH2:30]2)[cH:4][c:5]2[cH:6][c:7]([C:11](=[O:12])[N:13]3[CH2:14][CH2:15][N:16]([S:19](=[O:20])(=[O:21])[CH2:22][CH3:23])[CH2:17][CH2:18]3)[n:8]([CH2:41][C:42]([F:43])([F:44])[F:45])[c:9]2[cH:10]1