HRID313047

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID20328547

2-Bromo-N-tert-butyl-1,3-thiazole-5-carboxamide

C8H11BrN2OS

结构：CC(C)(O)CC1(c2ccccc2)CCN(C2CCCNC2)C(=O)O1

HCID66746656

未命名化合物

PRODUCTS

生成物

结构：CC(C)(O)CC1(c2ccccc2)CCN(C2CCCN(c3ncc(C(=O)NC(C)(C)C)s3)C2)C(=O)O1

HCID67019847

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f0412543549145b688a9e4e0e5fdcd54
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br:25][c:26]1[s:27][c:28]([C:31](=[O:32])[NH:33][C:34]([CH3:35])([CH3:36])[CH3:37])[cH:29][n:30]1.[OH:1][C:2]([CH2:3][C:4]1([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[CH2:5][CH2:6][N:7]([CH:11]2[CH2:12][NH:13][CH2:14][CH2:15][CH2:16]2)[C:8](=[O:10])[O:9]1)([CH3:23])[CH3:24]>>[OH:1][C:2]([CH2:3][C:4]1([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[CH2:5][CH2:6][N:7]([CH:11]2[CH2:12][N:13]([c:26]3[s:27][c:28]([C:31](=[O:32])[NH:33][C:34]([CH3:35])([CH3:36])[CH3:37])[cH:29][n:30]3)[CH2:14][CH2:15][CH2:16]2)[C:8](=[O:10])[O:9]1)([CH3:23])[CH3:24]