HRID135630

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

Dimethylformamide

C3H7NO

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID81531

Diisopropylethylamine

C8H19N

HCID133921

((4-Bromobenzyl)oxy)acetic acid

C9H9BrO3

HCID181649

3H-1,2,3-Triazolo[4,5-b]pyridine, 3-hydroxy-

C5H4N4O

HCID2757380

3-N-Cbz-Aminomethylaniline

C15H16N2O2

PRODUCTS

产物

反应SMILES：O=C(COCc1ccc(Br)cc1)Nc1cccc(CNC(=O)OCc2ccccc2)c1

HCID57842615

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-8767f416acff4cec838f36061ce2d2f7
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

[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][O:7][CH2:8][C:9](=[O:10])[OH:11])[cH:12][cH:13]1.[CH2:14]([c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)[O:21][C:22]([NH:23][CH2:24][c:25]1[cH:26][c:27]([NH2:31])[cH:28][cH:29][cH:30]1)=[O:32].[CH3:33][CH2:34][N:35]=[C:36]=[N:37][CH2:38][CH2:39][CH2:40][N:41]([CH3:42])[CH3:43].[CH:54]([N:55]([CH2:56][CH3:57])[CH:58]([CH3:59])[CH3:60])([CH3:61])[CH3:62].[O:63]=[CH:64][N:65]([CH3:66])[CH3:67].[OH:44][n:45]1[c:46]2[n:47][cH:48][cH:49][cH:50][c:51]2[n:52][n:53]1>>[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][O:7][CH2:8][C:9](=[O:11])[NH:31][c:27]2[cH:26][c:25]([CH2:24][NH:23][C:22]([O:21][CH2:14][c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)=[O:32])[cH:30][cH:29][cH:28]2)[cH:12][cH:13]1