HRID1138160

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID24841

Hydrogen iodide

HCID81531

Diisopropylethylamine

C8H19N

HCID22054433

未命名化合物

HCID140444318

未命名化合物

PRODUCTS

产物

HCID178449979

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-5679693abf934947a02d5b037330d981
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应SMILES

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