HRID93191

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

结构：COc1ccc(P2(=S)SP(=S)(c3ccc(OC)cc3)S2)cc1

HCID87949

p-Anisyldithiophosphonic anhydride

C14H14O2P2S4

结构：O=C1COCC(c2cc(N=C(c3ccccc3)c3ccccc3)ccc2F)(C2CC2)N1

HCID58155237

未命名化合物

PRODUCTS

生成物

结构：Fc1ccc(N=C(c2ccccc2)c2ccccc2)cc1C1(C2CC2)COCC(=S)N1

HCID58155199

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3e9d57a671ff4c29996ab4790e5b02df
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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