HRID105859

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID5152323

2-Chloro-4,6-dimethoxypyrimidine

C6H7ClN2O2

结构：O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC2(CC1)C(=O)NCN2c1ccccc1

HCID18401725

未命名化合物

PRODUCTS

生成物

结构：COc1cc(OC)nc(N2CN(c3ccccc3)C3(CCN(C(=O)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)CC3)C2=O)n1

HCID18401653

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d42ca7c3e43f4511bcb6bcb157d4f4a8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Cl:34][c:35]1[n:36][c:37]([O:43][CH3:44])[cH:38][c:39]([O:41][CH3:42])[n:40]1.[F:1][C:2]([c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][CH2:10][C:11]3([C:12](=[O:22])[NH:13][CH2:14][N:15]3[c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:23][CH2:24]2)[cH:25][c:26]([C:28]([F:29])([F:30])[F:31])[cH:27]1)([F:32])[F:33]>>[F:1][C:2]([c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][CH2:10][C:11]3([C:12](=[O:22])[N:13]([c:35]4[n:36][c:37]([O:43][CH3:44])[cH:38][c:39]([O:41][CH3:42])[n:40]4)[CH2:14][N:15]3[c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:23][CH2:24]2)[cH:25][c:26]([C:28]([F:29])([F:30])[F:31])[cH:27]1)([F:32])[F:33]