HRID1221458

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID76257

Diethylphosphorocyanidate

C5H10NO3P

HCID616002

4-Biphenylcarboxylic acid, 4'-chloro-

C13H9ClO2

HCID18625723

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(Cc1ccc(OCCNC(=O)c2ccc(-c3ccc(Cl)cc3)cc2)cc1)Oc1ccccc1

HCID18626003

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-06f4c0f88a894d4b953e9b91d334b40d
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

[C:1]([P:2](=[O:3])([O:4][CH2:5][CH3:6])[O:7][CH2:8][CH3:9])#[N:10].[CH3:51][CH2:52][N:53]([CH2:54][CH3:55])[CH2:56][CH3:57].[Cl:35][c:36]1[cH:37][cH:38][c:39](-[c:42]2[cH:43][cH:44][c:45]([C:48](=[O:49])[OH:50])[cH:46][cH:47]2)[cH:40][cH:41]1.[NH2:11][CH2:12][CH2:13][O:14][c:15]1[cH:16][cH:17][c:18]([CH2:21][CH:22]([C:23](=[O:24])[O:25][CH2:26][CH3:27])[O:28][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[cH:19][cH:20]1.[O:58]1[CH2:59][CH2:60][CH2:61][CH2:62]1>>[NH:11]([CH2:12][CH2:13][O:14][c:15]1[cH:16][cH:17][c:18]([CH2:21][CH:22]([C:23](=[O:24])[O:25][CH2:26][CH3:27])[O:28][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[cH:19][cH:20]1)[C:48]([c:45]1[cH:44][cH:43][c:42](-[c:39]2[cH:38][cH:37][c:36]([Cl:35])[cH:41][cH:40]2)[cH:47][cH:46]1)=[O:49]