HRID942722

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID68263

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

C7H6N4O

HCID3280088

未命名化合物

HCID12455201

未命名化合物

结构：COc1cc2c(cc1OC)C(Cc1ccc(F)cc1)N(CCNC(=O)OC(C)(C)C)CC2

HCID69763736

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(cc1OC)C(Cc1ccc(F)cc1)N(CCNC(=O)Nc1ccnc3nc(C)ccc13)CC2

HCID10143150

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-657a2a696ae2432a8cb9245c35b69a86
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([O:2][C:6]([NH:7][CH2:8][CH2:9][N:10]1[CH:11]([CH2:24][c:25]2[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]2)[c:12]2[cH:13][c:14]([O:22][CH3:23])[c:15]([O:20][CH3:21])[cH:16][c:17]2[CH2:18][CH2:19]1)=[O:32])([CH3:3])([CH3:4])[CH3:5].[C:34]([n:35]1[cH:36][cH:37][n:38][cH:39]1)([n:40]1[cH:41][cH:42][n:43][cH:44]1)=[O:45].[C:68]([OH:69])(=[O:70])[CH3:71].[CH3:59][Si:60]([N-:61][Si:62]([CH3:63])([CH3:64])[CH3:65])([CH3:66])[CH3:67].[ClH:33].[NH2:46][c:47]1[cH:48][cH:49][n:50][c:51]2[n:52][c:53]([CH3:57])[cH:54][cH:55][c:56]12.[Na+:58].[OH2:72]>>[C:6]([NH:7][CH2:8][CH2:9][N:10]1[CH:11]([CH2:24][c:25]2[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]2)[c:12]2[cH:13][c:14]([O:22][CH3:23])[c:15]([O:20][CH3:21])[cH:16][c:17]2[CH2:18][CH2:19]1)(=[O:32])[NH:46][c:47]1[cH:48][cH:49][n:50][c:51]2[n:52][c:53]([CH3:57])[cH:54][cH:55][c:56]12