HRID146657

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6328

Methyl iodide

CH3I

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

2 次

结构：CCCc1cc(C(=O)OC)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2

HCID15383771

Methyl 4-[1-(1,3-benzodioxol-5-yl)-2-[[[4-(1-methylethyl)phenyl]sulfonyl]amino]-2-oxoethoxy]-3-propylbenzoate

C29H31NO8S

HCID53627528

未命名化合物

2 次

PRODUCTS

生成物

结构：CCCc1cc(C(=O)OC)ccc1OC(C)(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2

HCID19080425

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-776f5260a88b42afba69ec8dcef7bd01
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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