HRID675566

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID7966

Cyclohexanol

C6H12O

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID21885

2-Dimethylaminopyridine

C7H10N2

结构：CC(C)(C)OC(=O)N1CCC(c2nc(C(=O)O)cs2)CC1

HCID2795531

2-[1-(tert-Butoxycarbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxylic acid

C14H20N2O4S

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(c2nc(C(=O)OC3CCCCC3)cs2)CC1

HCID44469190

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e4a3d28ef6e040adb972661496b4477c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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