HRID214892

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID75654

Diphenyl phosphorochloridate

C12H10ClO3P

HCID81531

Diisopropylethylamine

C8H19N

结构：CC(C)c1nc(N(C)S(C)(=O)=O)nc(-c2ccc(F)cc2)c1CO

HCID9819937

N-[4-(4-Fluorophenyl)-5-(hydroxymethyl)-6-(propan-2-yl)pyrimidin-2-yl]-N-methylmethanesulfonamide

C16H20FN3O3S

HCID11007884

2-Amino-3,4-dimethylpyridine

C7H10N2

PRODUCTS

生成物

结构：CC(C)c1nc(N(C)S(C)(=O)=O)nc(-c2ccc(F)cc2)c1COP(=O)(Oc1ccccc1)Oc1ccccc1

HCID67452498

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-65cb8bed243a4913b1121eb6157ad3cc
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

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