HRID800633

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID81531

Diisopropylethylamine

C8H19N

HCID1989641

2-Methyl-2-morpholinopropan-1-amine

C8H18N2O

结构：COC(=O)c1cc(S(=O)(=O)c2cnc(Cl)c(Br)c2)c(SC)s1

HCID21057179

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cc(S(=O)(=O)c2cnc(NCC(C)(C)N3CCOCC3)c(Br)c2)c(SC)s1

HCID69586470

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ccc8b65ae53c4208bccca4d7e5296c08
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

[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7]([S:21][CH3:22])[c:8]([S:10](=[O:11])(=[O:12])[c:13]2[cH:14][n:15][c:16]([Cl:20])[c:17]([Br:19])[cH:18]2)[cH:9]1.[CH3:23][C:24]([CH2:25][NH2:26])([CH3:27])[N:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1.[CH:34]([N:35]([CH:36]([CH3:37])[CH3:38])[CH2:39][CH3:40])([CH3:41])[CH3:42].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7]([S:21][CH3:22])[c:8]([S:10](=[O:11])(=[O:12])[c:13]2[cH:14][n:15][c:16]([NH:26][CH2:25][C:24]([CH3:23])([CH3:27])[N:28]3[CH2:29][CH2:30][O:31][CH2:32][CH2:33]3)[c:17]([Br:19])[cH:18]2)[cH:9]1