HRID203079

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID81531

Diisopropylethylamine

C8H19N

HCID23133494

未命名化合物

HCID66734853

未命名化合物

PRODUCTS

生成物

结构：CC1(CS(=O)(=O)N2CCc3cc(-c4cnc(C5CC5)nc4)ccc3C2)NC(=O)NC1=O

HCID69462180

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f48549ed20974e05bcd776a0cd4265a4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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