HRID159259

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl Acetate

C4H8O2

HCID28486

Lithium ion

Li+

HCID81121

6-Methoxy-3-pyridinylamine

C6H8N2O

HCID3280088

未命名化合物

HCID59548188

2-(2-Fluoro-5-((4-(methylsulfonyl)piperazin-1-yl)methyl)pyridin-3-yl)-4-methyl-6-(methylthio)-1,3,5-triazine

C16H21FN6O2S2

PRODUCTS

产物

HCID66599816

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-e6e9b6ba15174a7588129ec5c7984aae
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

[CH2:11]1[O:12][CH2:13][CH2:14][CH2:15]1.[CH3:2][Si:3]([N-:4][Si:5]([CH3:6])([CH3:7])[CH3:8])([CH3:9])[CH3:10].[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[Cl-:52].[F:16][c:17]1[n:18][cH:19][c:20]([CH2:32][N:33]2[CH2:34][CH2:35][N:36]([S:39](=[O:40])(=[O:41])[CH3:42])[CH2:37][CH2:38]2)[cH:21][c:22]1-[c:23]1[n:24][c:25]([S:30][CH3:31])[n:26][c:27]([CH3:29])[n:28]1.[Li+:1].[NH2:43][c:44]1[cH:45][n:46][c:47]([O:50][CH3:51])[cH:48][cH:49]1.[NH4+:53].[OH2:54]>>[c:17]1([NH:43][c:44]2[cH:45][n:46][c:47]([O:50][CH3:51])[cH:48][cH:49]2)[n:18][cH:19][c:20]([CH2:32][N:33]2[CH2:34][CH2:35][N:36]([S:39](=[O:40])(=[O:41])[CH3:42])[CH2:37][CH2:38]2)[cH:21][c:22]1-[c:23]1[n:24][c:25]([S:30][CH3:31])[n:26][c:27]([CH3:29])[n:28]1