HRID825958

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID961

Hydroxide

HO-

HCID962

Water

H2O

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

结构：Cc1ccc(S(=O)(=O)n2cc(-c3nc(NC(C)(C)C(=O)NCC(F)(F)F)ncc3C#N)c3cc(C(F)(F)F)cnc32)cc1

HCID59414605

未命名化合物

PRODUCTS

生成物

结构：CC(C)(Nc1ncc(C#N)c(-c2c[nH]c3ncc(C(F)(F)F)cc23)n1)C(=O)NCC(F)(F)F

HCID57471654

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2dc03c8ebc9447a8bdafd71557c2bf3e
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1](#[N:2])[c:3]1[c:4](-[c:21]2[cH:22][n:23]([S:34]([c:35]3[cH:36][cH:37][c:38]([CH3:39])[cH:40][cH:41]3)(=[O:42])=[O:43])[c:24]3[n:25][cH:26][c:27]([C:30]([F:31])([F:32])[F:33])[cH:28][c:29]23)[n:5][c:6]([NH:9][C:10]([C:11](=[O:12])[NH:13][CH2:14][C:15]([F:16])([F:17])[F:18])([CH3:19])[CH3:20])[n:7][cH:8]1.[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[Li+:46].[OH-:45].[OH2:44].[OH2:47]>>[C:1](#[N:2])[c:3]1[c:4](-[c:21]2[cH:22][nH:23][c:24]3[n:25][cH:26][c:27]([C:30]([F:31])([F:32])[F:33])[cH:28][c:29]23)[n:5][c:6]([NH:9][C:10]([C:11](=[O:12])[NH:13][CH2:14][C:15]([F:16])([F:17])[F:18])([CH3:19])[CH3:20])[n:7][cH:8]1