HRID2144120

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID7900

1-Methoxy-2-propanol

C4H10O2

HCID81531

Diisopropylethylamine

C8H19N

HCID57416138

2-(Methanesulfinyl)-7-(1H-pyrazol-1-yl)pyrrolo[2,1-f][1,2,4]triazine

C10H9N5OS

HCID57416144

2-Methoxy-4-[4-(morpholin-4-yl)piperidin-1-yl]aniline

C16H25N3O2

PRODUCTS

生成物

结构：COc1cc(N2CCC(N3CCOCC3)CC2)ccc1Nc1ncc2ccc(-n3cccn3)n2n1

HCID66712126

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bb07362a490c4224955781d798b5bb18
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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