HRID1559150

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

HCID5200229

3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl chloride

C8H6ClNO4S

HCID59023728

未命名化合物

PRODUCTS

生成物

结构：O=C1COc2ccc(S(=O)(=O)Nc3cc(-c4cc5ccccc5s4)c4[nH]ncc4c3)cc2N1

HCID59023866

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e5f5684450a244daad5e9db1a8734371
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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