HRID117248

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

2 次

HCID8028

Tetrahydrofuran

C4H8O

结构：O=C1C(=O)N(C(c2ccccc2)c2ccccc2)c2ccccc21

HCID1969277

1-(diphenylmethyl)-1H-indole-2,3-dione

C21H15NO2

HCID12203499

benzo[b]thiophen-5-ol

C8H6OS

HCID178461726

未命名化合物

PRODUCTS

生成物

结构：O=C1N(C(c2ccccc2)c2ccccc2)c2ccccc2C1(O)c1cc2sccc2cc1O

HCID68598097

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ccaf2c12c3894c8c8938b996e4fd915f
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

[CH:12]([Mg+:13])([CH3:14])[CH3:15].[Cl-:11].[Cl-:40].[Cl:47][CH2:48][CH2:49][Cl:50].[NH4+:41].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1.[c:16]1([CH:22]([N:23]2[C:24](=[O:33])[C:25](=[O:32])[c:26]3[cH:27][cH:28][cH:29][cH:30][c:31]32)[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:17][cH:18][cH:19][cH:20][cH:21]1.[s:1]1[c:2]2[c:3]([cH:4][cH:5]1)[cH:6][c:7]([OH:10])[cH:8][cH:9]2>>[s:1]1[c:2]2[c:3]([cH:4][cH:5]1)[cH:6][c:7]([OH:10])[c:8]([C:25]1([OH:32])[C:24](=[O:33])[N:23]([CH:22]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)[c:31]3[c:26]1[cH:27][cH:28][cH:29][cH:30]3)[cH:9]2