HRID1207325

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8028

Tetrahydrofuran

C4H8O

结构：CN(C)S(=O)(=O)n1cc(CC(C)(C)C)nc1C(O)C1(c2ccc(-c3ccccn3)cc2)SCCCS1

HCID86637791

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)Cc1c[nH]c(C(O)C2(c3ccc(-c4ccccn4)cc3)SCCCS2)n1

HCID178442243

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-184389d08c494e4ab0a68ef03423efa8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH3:2][C:3]([CH2:4][c:5]1[n:6][c:7]([CH:16]([C:17]2([c:23]3[cH:24][cH:25][c:26](-[c:29]4[n:30][cH:31][cH:32][cH:33][cH:34]4)[cH:27][cH:28]3)[S:18][CH2:19][CH2:20][CH2:21][S:22]2)[OH:35])[n:8]([S:10]([N:11]([CH3:12])[CH3:13])(=[O:14])=[O:15])[cH:9]1)([CH3:36])[CH3:37].[ClH:1].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1>>[CH3:2][C:3]([CH2:4][c:5]1[n:6][c:7]([CH:16]([C:17]2([c:23]3[cH:24][cH:25][c:26](-[c:29]4[n:30][cH:31][cH:32][cH:33][cH:34]4)[cH:27][cH:28]3)[S:18][CH2:19][CH2:20][CH2:21][S:22]2)[OH:35])[nH:8][cH:9]1)([CH3:36])[CH3:37]