HRID151972

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID31374

Dimethylacetamide

C4H9NO

HCID81184

1,8-Diazabicyclo[5.4.0]undec-7-ene

C9H16N2

HCID10945667

Carbamic acid, N-(4,6-dimethoxy-2-pyrimidinyl)-, phenyl ester

C13H13N3O4

HCID14837198

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(-n2cccc2)cc1S(=O)(=O)NC(=O)Nc1nc(OC)cc(OC)n1

HCID14837199

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b36c1dfa808d4c53a32a411662f706af
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH3:20][O:21][c:22]1[n:23][c:24]([NH:30][C:31]([O:32][c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)=[O:33])[n:25][c:26]([O:28][CH3:29])[cH:27]1.[CH3:52][N:53]([CH3:54])[C:55](=[O:56])[CH3:57].[ClH:51].[N:40]12[CH2:41][CH2:42][CH2:43][N:44]=[C:45]1[CH2:46][CH2:47][CH2:48][CH2:49][CH2:50]2.[NH2:1][S:2](=[O:3])(=[O:4])[c:5]1[c:6]([C:7](=[O:8])[O:9][CH3:10])[cH:11][cH:12][c:13](-[n:15]2[cH:16][cH:17][cH:18][cH:19]2)[cH:14]1.[OH2:58]>>[NH:1]([S:2](=[O:3])(=[O:4])[c:5]1[c:6]([C:7](=[O:8])[O:9][CH3:10])[cH:11][cH:12][c:13](-[n:15]2[cH:16][cH:17][cH:18][cH:19]2)[cH:14]1)[C:31]([NH:30][c:24]1[n:23][c:22]([O:21][CH3:20])[cH:27][c:26]([O:28][CH3:29])[n:25]1)=[O:32]