HRID210030

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID10442

1,3-Propanediol

C3H8O2

HCID5360545

Sodium

HCID53744388

N-[6-chloro-5-(2-methoxyphenoxy)-2-(2-pyrimidinyl)-4-pyrimidinyl]-2-phenylethenesulfonamide

C23H18ClN5O4S

PRODUCTS

产物

HCID54390431

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-8747e795f34149399e3e506a93c6fb50
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应SMILES

[CH2:37]([CH2:38][CH2:39][OH:40])[OH:41].[Cl:2][c:3]1[c:4]([O:27][c:28]2[c:29]([O:34][CH3:35])[cH:30][cH:31][cH:32][cH:33]2)[c:5]([NH:15][S:16](=[O:17])(=[O:18])[CH:19]=[CH:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[n:6][c:7](-[c:9]2[n:10][cH:11][cH:12][cH:13][n:14]2)[n:8]1.[ClH:36].[Na:1]>>[c:3]1([O:41][CH2:37][CH2:38][CH2:39][OH:40])[c:4]([O:27][c:28]2[c:29]([O:34][CH3:35])[cH:30][cH:31][cH:32][cH:33]2)[c:5]([NH:15][S:16](=[O:17])(=[O:18])[CH:19]=[CH:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[n:6][c:7](-[c:9]2[n:10][cH:11][cH:12][cH:13][n:14]2)[n:8]1