HRID316404

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12

HCID2399

Arcyriarubin A

C20H13N3O2

HCID8071

未命名化合物

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

HCID87949

p-Anisyldithiophosphonic anhydride

C14H14O2P2S4

PRODUCTS

生成物

结构：O=C1NC(=S)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12

HCID18780299

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ff975135bab7432d966b78dfb0af46b5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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