HRID688108

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID28486

Lithium ion

Li+

HCID31297

Methanesulfonyl chloride

CH3ClO2S

HCID104727

Aluminum Cation

Al+3

HCID166653

Hydride

H-

4 次

HCID2735440

1-benzhydrylazetidine-3-carboxylic acid

C17H17NO2

HCID2758715

(1-benzhydrylazetidin-3-yl)methanol

C17H19NO

PRODUCTS

生成物

结构：CS(=O)(=O)OCC1CN(C(c2ccccc2)c2ccccc2)C1

HCID21978370

[1-(Diphenylmethyl)azetidin-3-yl]methyl methanesulfonate

C18H21NO3S

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-68245d4d60c74a5dad848ff3c5c0320f
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

[Al+3:41].[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[CH3:53][S:54]([Cl:55])(=[O:56])=[O:57].[H-:40].[H-:43].[H-:44].[H-:45].[Li+:42].[c:1]1([CH:7]([N:8]2[CH2:9][CH:10]([CH2:12][OH:13])[CH2:11]2)[c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[c:20]1([CH:21]([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[N:28]2[CH2:29][CH:30]([C:31]([OH:32])=[O:33])[CH2:34]2)[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[c:1]1([CH:7]([N:8]2[CH2:9][CH:10]([CH2:12][O:13][S:54]([CH3:53])(=[O:56])=[O:57])[CH2:11]2)[c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1