HRID807879

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID28486

Lithium ion

Li+

HCID79305

5-Amino-2-chloropyridine

C5H5ClN2

HCID3280088

未命名化合物

结构：COc1ccc(CN(Cc2ccc(OC)cc2)c2nc(C)nc(-c3cccnc3F)n2)cc1

HCID59548240

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(CN(Cc2ccc(OC)cc2)c2nc(C)nc(-c3cccnc3Nc3ccc(Cl)nc3)n2)cc1

HCID59548227

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-18ec75ffb1fa4f96bcde65ae943f0846
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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