HRID1229420

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID88358

Phosphonic acid, p-aminobenzyl-, diethyl ester

C11H18NO3P

HCID15922445

未命名化合物

PRODUCTS

生成物

结构：CCOP(=O)(Cc1ccc(NC(=O)C2Cc3cc4c(cc3C(=O)C(C)S2)OCO4)cc1)OCC

HCID22048216

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d7172073c06d4836bbe61d30a6f23834
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

[CH3:1][CH:2]1[C:3](=[O:19])[c:4]2[c:5]([cH:12][c:13]3[c:14]([cH:15]2)[O:16][CH2:17][O:18]3)[CH2:6][CH:7]([C:9](=[O:10])[OH:11])[S:8]1.[CH3:50][N:51]([CH3:52])[CH:53]=[O:54].[Cl:47][CH2:48][Cl:49].[NH2:20][c:21]1[cH:22][cH:23][c:24]([CH2:25][P:26]([O:27][CH2:28][CH3:29])([O:30][CH2:31][CH3:32])=[O:33])[cH:34][cH:35]1.[OH2:46].[OH:36][n:37]1[c:38]2[cH:39][cH:40][cH:41][cH:42][c:43]2[n:44][n:45]1>>[CH3:1][CH:2]1[C:3](=[O:19])[c:4]2[c:5]([cH:12][c:13]3[c:14]([cH:15]2)[O:16][CH2:17][O:18]3)[CH2:6][CH:7]([C:9](=[O:11])[NH:20][c:21]2[cH:22][cH:23][c:24]([CH2:25][P:26]([O:27][CH2:28][CH3:29])([O:30][CH2:31][CH3:32])=[O:33])[cH:34][cH:35]2)[S:8]1