HRID1233503

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1049

Pyridine

C5H5N

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID410813

3-(Morpholin-4-yl)propanoic acid

C7H13NO3

结构：COC(=O)Oc1cc(Nc2ncnc3cc(N)ccc23)c(F)cc1C

HCID22625085

未命名化合物

PRODUCTS

生成物

结构：COC(=O)Oc1cc(Nc2ncnc3cc(NC(=O)CCN4CCOCC4)ccc23)c(F)cc1C

HCID21260355

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ae5bfe9f6e4d4e8a87145dcdddb8f8ad
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

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