HRID814111

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID923

Sodium ion

Na+

HCID943

Nitrate

NO3-

HCID962

Water

H2O

2 次

结构：C=C(C)C(C(=O)OC(c1ccccc1)c1ccccc1)N1C(=O)C(NC(=O)COc2ccccc2)C1SSc1nc2ccccc2s1

HCID99988

未命名化合物

HCID104755

Silver ion (1+)

Ag+

HCID277296

4-Methylbenzene-1-sulfinate

C7H7O2S-

PRODUCTS

生成物

结构：C=C(C)C(C(=O)OC(c1ccccc1)c1ccccc1)N1C(=O)C(NC(=O)COc2ccccc2)C1SS(=O)(=O)c1ccc(C)cc1

HCID12805475

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5674a238235b453dac071bac77cd8630
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

[Ag+:69].[CH3:60][C:61](=[O:62])[CH3:63].[N+:65]([O-:66])([O-:67])=[O:68].[Na+:59].[OH2:48].[OH2:64].[c:49]1([CH3:58])[cH:50][cH:51][c:52]([S:55](=[O:56])[O-:57])[cH:53][cH:54]1.[s:1]1[c:2]2[cH:3][cH:4][cH:5][cH:6][c:7]2[n:8][c:9]1[S:10][S:11][CH:12]1[CH:13]([NH:37][C:38]([CH2:39][O:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)=[O:47])[C:14](=[O:36])[N:15]1[CH:16]([C:17](=[O:18])[O:19][CH:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[C:33](=[CH2:34])[CH3:35]>>[S:11]([CH:12]1[CH:13]([NH:37][C:38]([CH2:39][O:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)=[O:47])[C:14](=[O:36])[N:15]1[CH:16]([C:17](=[O:18])[O:19][CH:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[C:33](=[CH2:34])[CH3:35])[S:55]([c:52]1[cH:51][cH:50][c:49]([CH3:58])[cH:54][cH:53]1)(=[O:56])=[O:57]