HRID208818

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID220568

ethyl N-ethoxycarbonyliminocarbamate

C6H10N2O4

HCID289575

(3,5-Dimethyl-4-isoxazolyl)methanol

C6H9NO2

结构：COC(=O)C(Cc1ccc(O)cc1)NC1=NS(=O)(=O)c2ccccc21

HCID178499948

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(Cc1ccc(OCc2c(C)noc2C)cc1)NC1=NS(=O)(=O)c2ccccc21

HCID178499973

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-03508ed0ca4d409380e1dc6f30488b9e
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

[CH3:1][c:2]1[n:3][o:4][c:5]([CH3:9])[c:6]1[CH2:7][OH:8].[O:10]=[S:11]1(=[O:34])[N:12]=[C:13]([NH:20][CH:21]([C:22](=[O:23])[O:24][CH3:25])[CH2:26][c:27]2[cH:28][cH:29][c:30]([OH:33])[cH:31][cH:32]2)[c:14]2[c:15]1[cH:16][cH:17][cH:18][cH:19]2.[O:54]=[C:55]([O:56][CH2:57][CH3:58])[N:59]=[N:60][C:61]([O:62][CH2:63][CH3:64])=[O:65].[O:66]1[CH2:67][CH2:68][CH2:69][CH2:70]1.[c:35]1([P:36]([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[cH:49][cH:50][cH:51][cH:52][cH:53]1>>[CH3:1][c:2]1[n:3][o:4][c:5]([CH3:9])[c:6]1[CH2:7][O:8][c:30]1[cH:29][cH:28][c:27]([CH2:26][CH:21]([NH:20][C:13]2=[N:12][S:11](=[O:10])(=[O:34])[c:15]3[c:14]2[cH:19][cH:18][cH:17][cH:16]3)[C:22](=[O:23])[O:24][CH3:25])[cH:32][cH:31]1