HRID191776

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID3017625

(4-Nitrophenyl)methyl hydrogen (2-sulfanylethyl)carbonimidate

C10H12N2O4S

结构：C[SiH](C)OCC(C1C(=O)NC1CC(=O)O)C(C)(C)C

HCID178504530

未命名化合物

PRODUCTS

生成物

结构：C[SiH](C)OCC(C1C(=O)NC1CC(=O)SCCNC(=O)OCc1ccc([N+](=O)[O-])cc1)C(C)(C)C

HCID178504533

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4f1fe6569fd04824ba51d3a390eb8ecc
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

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