HRID304706

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6395

Methanesulfonic acid

CH4O3S

HCID2776358

(4-benzylmorpholin-2-yl)methanol

C12H17NO2

HCID135697906

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(Oc3ccc(F)cc3Br)ncnc2cc1OCC1CN(Cc2ccccc2)CCO1

HCID22243808

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e8772442f5814523bf8d4d44146cd341
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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