HRID176616

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID3371655

Isoquinoline-5-sulfonyl Chloride

C9H6ClNO2S

结构：CC(C)(C)OC(=O)N1C(CCc2ccc(N)cc2)COC1(C)C

HCID66705808

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1C(CCc2ccc(NS(=O)(=O)c3cccc4cnccc34)cc2)COC1(C)C

HCID67151691

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7d5844fe21224fcbb7cf754f877a4121
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

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