HRID2147796

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7498

alpha-Bromotoluene

C7H7Br

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

HCID3280088

未命名化合物

结构：CCNc1ccc(C(C)=O)cc1N=C1SCC(=O)N1Cc1ccccc1

HCID21937583

未命名化合物

PRODUCTS

生成物

结构：CCNc1ccc(C(C)=O)cc1N=C1SC(Cc2ccccc2)C(=O)N1Cc1ccccc1

HCID11583386

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9b413158d6c644e189dc8b212d7dfd15
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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