HRID808462

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

Dimethylformamide

C3H7NO

HCID7464

Cumidine

C9H13N

HCID8471

Triethylamine

C6H15N

HCID76257

Diethylphosphorocyanidate

C5H10NO3P

反应SMILES：COc1ccc(CC2SC(=O)NC2=O)c2c1N(Cc1ccc(C(=O)O)cc1)C(=O)CC2

HCID86613942

未命名化合物

PRODUCTS

产物

反应SMILES：COc1ccc(CC2SC(=O)NC2=O)c2c1N(Cc1ccc(C(=O)Nc3ccc(C(C)C)cc3)cc1)C(=O)CC2

HCID86613943

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-358132fd4daf4c9b97b16db1cd85f32d
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

[CH3:18][O:19][c:20]1[cH:21][cH:22][c:23]([CH2:41][CH:42]2[C:43](=[O:48])[NH:44][C:45](=[O:47])[S:46]2)[c:24]2[c:29]1[N:28]([CH2:30][c:31]1[cH:32][cH:33][c:34]([C:37](=[O:38])[OH:39])[cH:35][cH:36]1)[C:27](=[O:40])[CH2:26][CH2:25]2.[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH:49]([CH3:50])([CH3:51])[c:52]1[cH:53][cH:54][c:55]([NH2:56])[cH:57][cH:58]1.[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[OH2:59].[P:8]([C:9]#[N:10])(=[O:11])([O:12][CH2:13][CH3:14])[O:15][CH2:16][CH3:17]>>[CH3:18][O:19][c:20]1[cH:21][cH:22][c:23]([CH2:41][CH:42]2[C:43](=[O:48])[NH:44][C:45](=[O:47])[S:46]2)[c:24]2[c:29]1[N:28]([CH2:30][c:31]1[cH:32][cH:33][c:34]([C:37](=[O:38])[NH:56][c:55]3[cH:54][cH:53][c:52]([CH:49]([CH3:50])[CH3:51])[cH:58][cH:57]3)[cH:35][cH:36]1)[C:27](=[O:40])[CH2:26][CH2:25]2