HRID1215958

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

结构：COc1ccc2c(c1)CC(CCN(C)C(=O)OC(C)(C)C)Cn1c-2c(C2CCCCC2)c2ccc(C(=O)O)cc21

HCID67345021

未命名化合物

HCID86627889

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2c(c1)CC(CCN(C)C(=O)OC(C)(C)C)Cn1c-2c(C2CCCCC2)c2ccc(C(=O)NS(=O)(=O)N(C)CC(OC)OC)cc21

HCID67342477

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bb98fdee2c1f4e199c2d29f2df727379
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([CH2:9][CH2:10][CH:11]1[CH2:12][n:13]2[c:14]([c:24]([CH:34]3[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]3)[c:25]3[cH:26][cH:27][c:28]([C:31](=[O:32])[OH:33])[cH:29][c:30]23)-[c:15]2[c:16]([cH:18][c:19]([O:22][CH3:23])[cH:20][cH:21]2)[CH2:17]1)[CH3:40].[CH2:53]([Cl:54])[CH2:55][Cl:56].[CH3:41][O:42][CH:43]([CH2:44][N:45]([S:46](=[O:47])(=[O:48])[NH2:49])[CH3:50])[O:51][CH3:52].[CH3:60][N:61]([c:62]1[cH:63][cH:64][n:65][cH:66][cH:67]1)[CH3:68].[CH3:69][CH2:70][O:71][C:72]([CH3:73])=[O:74].[Cl:57][CH2:58][Cl:59]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([CH2:9][CH2:10][CH:11]1[CH2:12][n:13]2[c:14]([c:24]([CH:34]3[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]3)[c:25]3[cH:26][cH:27][c:28]([C:31](=[O:32])[NH:49][S:46]([N:45]([CH2:44][CH:43]([O:42][CH3:41])[O:51][CH3:52])[CH3:50])(=[O:47])=[O:48])[cH:29][c:30]23)-[c:15]2[c:16]([cH:18][c:19]([O:22][CH3:23])[cH:20][cH:21]2)[CH2:17]1)[CH3:40]