HRID1117945

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID5011

Quipazine

C13H15N3

HCID6342

Acetonitrile

C2H3N

HCID81531

Diisopropylethylamine

C8H19N

HCID14280583

未命名化合物

PRODUCTS

产物

HCID14280594

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-a39ff66e85e84ef6b1ac0b275a72a116
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应SMILES

[Br:1][CH2:2][CH2:3][CH2:4][O:5][N:6]1[C:7](=[O:17])[CH2:8][C:9]2([CH2:10][CH2:11][CH2:12][CH2:13]2)[CH2:14][C:15]1=[O:16].[CH3:43][C:44]#[N:45].[CH:34]([N:35]([CH:36]([CH3:37])[CH3:38])[CH2:39][CH3:40])([CH3:41])[CH3:42].[n:18]1[c:19]([N:28]2[CH2:29][CH2:30][NH:31][CH2:32][CH2:33]2)[cH:20][cH:21][c:22]2[cH:23][cH:24][cH:25][cH:26][c:27]12>>[CH2:2]([CH2:3][CH2:4][O:5][N:6]1[C:7](=[O:17])[CH2:8][C:9]2([CH2:10][CH2:11][CH2:12][CH2:13]2)[CH2:14][C:15]1=[O:16])[N:31]1[CH2:30][CH2:29][N:28]([c:19]2[n:18][c:27]3[c:22]([cH:21][cH:20]2)[cH:23][cH:24][cH:25][cH:26]3)[CH2:33][CH2:32]1