HRID142891

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID10214733

未命名化合物

结构：COc1ccc(C(C(F)(F)F)C(F)(F)F)cc1CNC1CCCN(C(=O)OC(C)(C)C)C1c1ccccc1

HCID17814226

未命名化合物

HCID18677658

未命名化合物

PRODUCTS

生成物

结构：COc1cc(OC)c(CC(F)(F)F)cc1CNC1CCCN(C(=O)OC(C)(C)C)C1c1ccccc1

HCID18677640

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d5b5cda1f3f74787b1afa76266443eb8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:38]([O:39][C:40]([N:41]1[CH2:42][CH2:43][CH2:44][CH:45]([NH:46][CH2:47][c:48]2[cH:49][c:50]([CH:51]([C:52]([F:53])([F:54])[F:55])[C:56]([F:57])([F:58])[F:59])[cH:60][cH:61][c:62]2[O:63][CH3:64])[CH:65]1[c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1)=[O:72])([CH3:73])([CH3:74])[CH3:75].[CH3:21][O:22][c:23]1[c:24]([CH:25]=[O:26])[cH:27][c:28]([CH2:33][C:34]([F:35])([F:36])[F:37])[c:29]([O:31][CH3:32])[cH:30]1.[NH2:1][CH:2]1[CH:3]([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[N:4]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[CH2:5][CH2:6][CH2:7]1>>[NH:1]([CH:2]1[CH:3]([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[N:4]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[CH2:5][CH2:6][CH2:7]1)[CH2:25][c:24]1[c:23]([O:22][CH3:21])[cH:30][c:29]([O:31][CH3:32])[c:28]([CH2:33][C:34]([F:35])([F:36])[F:37])[cH:27]1