HRID2132721

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID26255

Tetrafluoroborate

BF4-

HCID130500

未命名化合物

HCID270655

Boc-DL-valine

C10H19NO4

HCID10727275

4-Methyl-N1-(phenylmethyl)-1,2-benzenediamine

C14H16N2

PRODUCTS

生成物

结构：Cc1ccc(NCc2ccccc2)c(NC(=O)C(NC(=O)OC(C)(C)C)C(C)C)c1

HCID66886932

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e8d75b46988d4dc7a912149a813ab180
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[B-:39]([F:40])([F:41])([F:42])[F:43].[C:24](=[O:25])([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[NH:31][CH:32]([CH:33]([CH3:34])[CH3:35])[C:36](=[O:37])[OH:38].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][c:9]1[c:10]([NH2:16])[cH:11][c:12]([CH3:15])[cH:13][cH:14]1.[CH3:17][CH2:18][N:19]([CH2:20][CH3:21])[CH2:22][CH3:23].[CH3:66][CH2:67][O:68][C:69](=[O:70])[CH3:71].[O:61]=[CH:62][N:63]([CH3:64])[CH3:65].[n:44]1([O:45][C:46]([N:47]([CH3:48])[CH3:49])=[N+:50]([CH3:51])[CH3:52])[c:53]2[cH:54][cH:55][cH:56][cH:57][c:58]2[n:59][n:60]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][c:9]1[c:10]([NH:16][C:36]([CH:32]([NH:31][C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH:33]([CH3:34])[CH3:35])=[O:37])[cH:11][c:12]([CH3:15])[cH:13][cH:14]1