HRID1572890

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6212

Chloroform

CHCl3

HCID8028

Tetrahydrofuran

C4H8O

HCID76926

tert-Butyl (2-((2,5-dioxo-1-pyrrolidinyl)oxy)-2-oxoethyl)carbamate

C11H16N2O6

结构：Cn1ncc(NC(=O)C(N)CCCNC(=O)OC(C)(C)C)c1NC(c1ccccc1)(c1ccccc1)c1ccccc1

HCID178481904

未命名化合物

PRODUCTS

生成物

结构：Cn1ncc(NC(=O)C(CCCNC(=O)OC(C)(C)C)NC(=O)CNC(=O)OC(C)(C)C)c1NC(c1ccccc1)(c1ccccc1)c1ccccc1

HCID178481890

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e61a3ace89844af9bdcec47f81bc56b0
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:43]([CH3:44])([CH3:45])([CH3:46])[O:47][C:48](=[O:49])[NH:50][CH2:51][C:52](=[O:53])[O:54][N:55]1[C:56](=[O:57])[CH2:58][CH2:59][C:60]1=[O:61].[CH:62]([Cl:63])([Cl:64])[Cl:65].[NH2:1][CH:2]([CH2:3][CH2:4][CH2:5][NH:6][C:7]([O:8][C:9]([CH3:10])([CH3:11])[CH3:12])=[O:13])[C:14](=[O:15])[NH:16][c:17]1[cH:18][n:19][n:20]([CH3:42])[c:21]1[NH:22][C:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[O:66]1[CH2:67][CH2:68][CH2:69][CH2:70]1>>[NH:1]([CH:2]([CH2:3][CH2:4][CH2:5][NH:6][C:7]([O:8][C:9]([CH3:10])([CH3:11])[CH3:12])=[O:13])[C:14](=[O:15])[NH:16][c:17]1[cH:18][n:19][n:20]([CH3:42])[c:21]1[NH:22][C:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)[C:52]([CH2:51][NH:50][C:48]([O:47][C:43]([CH3:44])([CH3:45])[CH3:46])=[O:49])=[O:53]