HRID1564781

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID187201

N-Boc-ethylenediamine

C7H16N2O2

结构：Cc1ccc(S(=O)(=O)Oc2ccc3c4c(nn3CCNC(=O)OC(C)(C)C)-c3cnccc3C(=O)c24)cc1

HCID10506481

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NCCNc1ccc2c3c(nn2CCNC(=O)OC(C)(C)C)-c2cnccc2C(=O)c13

HCID10815879

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-26252a8816f746309e74aec0f58d739e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][CH2:10][n:11]1[n:12][c:13]2[c:14]3[c:15]([c:16]([O:20][S:21]([c:22]4[cH:23][cH:24][c:25]([CH3:26])[cH:27][cH:28]4)(=[O:29])=[O:30])[cH:17][cH:18][c:19]13)[C:31](=[O:38])[c:32]1[cH:33][cH:34][n:35][cH:36][c:37]1-2.[C:39]([CH3:40])([CH3:41])([CH3:42])[O:43][C:44](=[O:45])[NH:46][CH2:47][CH2:48][NH2:49].[cH:50]1[cH:51][cH:52][n:53][cH:54][cH:55]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][CH2:10][n:11]1[n:12][c:13]2[c:14]3[c:15]([c:16]([NH:49][CH2:48][CH2:47][NH:46][C:44]([O:43][C:39]([CH3:40])([CH3:41])[CH3:42])=[O:45])[cH:17][cH:18][c:19]13)[C:31](=[O:38])[c:32]1[cH:33][cH:34][n:35][cH:36][c:37]1-2