HRID2123984

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID31275

1,4-Dioxane

C4H8O2

HCID702235

未命名化合物

结构：CN(C)C1(c2ccccc2)CCC(CNC(=O)Oc2ccccc2)CC1

HCID67531743

未命名化合物

PRODUCTS

生成物

结构：CN(C)C1(c2ccccc2)CCC(CNC(=O)N2CCC(c3c[nH]c4ccccc34)CC2)CC1

HCID10416821

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2070317a9ee84350a199cce2f8dc2a57
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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