HRID1240269

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID13524810

Methyl 2,4,6-trimethylbenzeneacetate

C12H16O2

HCID86663300

未命名化合物

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(C(=O)C1(SCc2ccc(OC)cc2)CCN(OC)CC1)c1c(C)cc(C)cc1C

HCID66793890

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9a1fbe6e3b12446d9ce37529e77a5594
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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