HRID2131712

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID68263

1,1'-Carbonylbis(1H-imidazole)

C7H6N4O

HCID81531

Diisopropylethylamine

C8H19N

反应SMILES：CN(CC(N)CC1CCCCC1)C(=O)OC(C)(C)C

HCID66704446

未命名化合物

反应SMILES：COC(=O)NCCOC(c1cccc(F)c1)C1CCCNC1

HCID67365379

未命名化合物

PRODUCTS

产物

反应SMILES：COC(=O)NCCOC(c1cccc(F)c1)C1CCCN(C(=O)NC(CC2CCCCC2)CN(C)C(=O)OC(C)(C)C)C1

HCID72529686

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-4d0840aeb5fb4916b48f2450b10e1c72
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

[C:20](=[O:21])([n:22]1[cH:23][cH:24][n:25][cH:26]1)[n:27]1[cH:28][cH:29][n:30][cH:31]1.[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40].[Cl:63][CH2:64][Cl:65].[F:41][c:42]1[cH:43][c:44]([CH:48]([O:49][CH2:50][CH2:51][NH:52][C:53]([O:54][CH3:55])=[O:56])[CH:57]2[CH2:58][NH:59][CH2:60][CH2:61][CH2:62]2)[cH:45][cH:46][cH:47]1.[NH2:1][CH:2]([CH2:3][N:4]([C:5]([O:6][C:7]([CH3:8])([CH3:9])[CH3:10])=[O:11])[CH3:12])[CH2:13][CH:14]1[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]1>>[NH:1]([CH:2]([CH2:3][N:4]([C:5]([O:6][C:7]([CH3:8])([CH3:9])[CH3:10])=[O:11])[CH3:12])[CH2:13][CH:14]1[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]1)[C:20](=[O:21])[N:59]1[CH2:58][CH:57]([CH:48]([c:44]2[cH:43][c:42]([F:41])[cH:47][cH:46][cH:45]2)[O:49][CH2:50][CH2:51][NH:52][C:53]([O:54][CH3:55])=[O:56])[CH2:62][CH2:61][CH2:60]1