HRID186505

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID68263

1,1'-Carbonylbis(1H-imidazole)

C7H6N4O

HCID81184

1,8-Diazabicyclo[5.4.0]undec-7-ene

C9H16N2

HCID15765418

Cyclopropanesulfonamide

C3H7NO2S

结构：COC(=O)c1ccc2c(c1)CC(C)(C)C(c1cccc(C(=O)O)c1)N2

HCID67441976

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc2c(c1)CC(C)(C)C(c1cccc(C(=O)NS(=O)(=O)C3CC3)c1)N2

HCID67442049

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-501a522339774e42aa12927d06e43d64
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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