HRID179587

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID1479740

(2-chloro-1,3-thiazol-5-yl)methyl N-phenylcarbamate

C11H9ClN2O2S

结构：CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1ccc(B2OC(C)(C)C(C)(C)O2)cc1

HCID59830883

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1ccc(-c2ncc(COC(=O)Nc3ccccc3)s2)cc1

HCID68407987

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8487f8d6f8764964837cbd40a0cd816a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[c:10]([NH:15][C:16]([c:17]2[cH:18][cH:19][c:20]([B:23]3[O:24][C:25]([CH3:26])([CH3:27])[C:28]([CH3:29])([CH3:30])[O:31]3)[cH:21][cH:22]2)=[O:32])[cH:11][cH:12][cH:13][cH:14]1.[C:51]([O:52][CH2:53][CH3:54])(=[O:55])[CH3:56].[OH2:50].[c:33]1([NH:39][C:40]([O:41][CH2:42][c:43]2[cH:44][n:45][c:46]([Cl:48])[s:47]2)=[O:49])[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[c:10]([NH:15][C:16]([c:17]2[cH:18][cH:19][c:20](-[c:46]3[n:45][cH:44][c:43]([CH2:42][O:41][C:40]([NH:39][c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)=[O:49])[s:47]3)[cH:21][cH:22]2)=[O:32])[cH:11][cH:12][cH:13][cH:14]1