HRID108297

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID887

Methanol

CH4O

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

HCID3280088

未命名化合物

结构：CS(=O)(=O)c1ccccc1-c1ccc2[nH]c(COc3ccc(C(F)(F)F)cc3)nc2c1

HCID178504705

未命名化合物

PRODUCTS

生成物

结构：CC(C)(O)CS(=O)(=O)c1ccccc1-c1ccc2[nH]c(COc3ccc(C(F)(F)F)cc3)nc2c1

HCID178459943

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1de89c4b55bf41db947ef12713ef5b62
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

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