HRID1239517

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID23510331

3-(Bromomethyl)quinoline

C10H8BrN

结构：CC(C)c1nc(COCc2ccccc2)[nH]c1Sc1cc(Cl)cc(Cl)c1

HCID178419034

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1c(Sc2cc(Cl)cc(Cl)c2)nc(COCc2ccccc2)n1Cc1cnc2ccccc2c1

HCID22130469

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-70d15b4e49d84205b642ec5ac4f3abe5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH2:9][c:10]1[nH:11][c:12]([S:18][c:19]2[cH:20][c:21]([Cl:26])[cH:22][c:23]([Cl:25])[cH:24]2)[c:13]([CH:15]([CH3:16])[CH3:17])[n:14]1.[CH2:27]([Cl:28])[Cl:29].[Na+:43].[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1.[OH-:42].[n:30]1[cH:31][c:32]([CH2:40][Br:41])[cH:33][c:34]2[cH:35][cH:36][cH:37][cH:38][c:39]12>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH2:9][c:10]1[n:11][c:12]([S:18][c:19]2[cH:20][c:21]([Cl:26])[cH:22][c:23]([Cl:25])[cH:24]2)[c:13]([CH:15]([CH3:16])[CH3:17])[n:14]1[CH2:40][c:32]1[cH:31][n:30][c:39]2[c:34]([cH:33]1)[cH:35][cH:36][cH:37][cH:38]2