HRID163970

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID67749

Trifluoromethanesulfonic anhydride

C2F6O5S2

HCID81531

Diisopropylethylamine

C8H19N

HCID11182839

6-chloro-1,2,3,4-tetrahydroquinoline

C9H10ClN

结构：C=CCN(c1nccs1)S(=O)(=O)c1ccc(N2CCC(O)C2=O)nc1

HCID67337287

未命名化合物

PRODUCTS

生成物

结构：C=CCN(c1nccs1)S(=O)(=O)c1ccc(N2CCC(N3CCCc4cc(Cl)ccc43)C2=O)nc1

HCID67337072

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a57f2b34bbf04b1182cbb86acbb9030c
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

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