HRID173575

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

结构：CC(C)C(=O)c1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1

HCID10150490

isopropyl(1-trityl-1H-imidazol-4-yl)ketone

C26H24N2O

HCID21879639

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

结构：CC(C)N(C(=O)c1ccc2cc(C(O)(c3cn(C(c4ccccc4)(c4ccccc4)c4ccccc4)cn3)C(C)C)ccc2c1)C(C)C

HCID22285063

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-352939bfe3ba44b48ec4632a11c18d9d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[Br:13][c:14]1[cH:15][c:16]2[cH:17][cH:18][c:19]([C:24](=[O:25])[N:26]([CH:27]([CH3:28])[CH3:29])[CH:30]([CH3:31])[CH3:32])[cH:20][c:21]2[cH:22][cH:23]1.[CH2:68]1[O:69][CH2:70][CH2:71][CH2:72]1.[CH3:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[CH3:33][CH:34]([C:35](=[O:36])[c:37]1[n:38][cH:39][n:40]([C:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[cH:41]1)[CH3:61].[CH3:62][CH2:63][CH2:64][CH2:65][CH2:66][CH3:67].[Li:8][CH2:9][CH2:10][CH2:11][CH3:12].[OH2:73]>>[c:14]1([C:35]([CH:34]([CH3:33])[CH3:61])([OH:36])[c:37]2[n:38][cH:39][n:40]([C:42]([c:43]3[cH:44][cH:45][cH:46][cH:47][cH:48]3)([c:49]3[cH:50][cH:51][cH:52][cH:53][cH:54]3)[c:55]3[cH:56][cH:57][cH:58][cH:59][cH:60]3)[cH:41]2)[cH:15][c:16]2[cH:17][cH:18][c:19]([C:24](=[O:25])[N:26]([CH:27]([CH3:28])[CH3:29])[CH:30]([CH3:31])[CH3:32])[cH:20][c:21]2[cH:22][cH:23]1