HRID314684

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

2 次

HCID8900

Heptane

C7H16

HCID14917

Hydrogen fluoride

结构：CC(C)(C)[Si](C)(C)OC1CCC(NC(=O)N(c2cccc(Cl)c2)c2c3ccccc3nn2-c2ccc(Cl)cc2)CC1

HCID66905689

未命名化合物

PRODUCTS

生成物

结构：O=C(NC1CCC(O)CC1)N(c1cccc(Cl)c1)c1c2ccccc2nn1-c1ccc(Cl)cc1

HCID45111626

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fb48a3d3953c4f669f877f92beef1976
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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