HRID134924

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7972

4-Methylmorpholine

C5H11NO

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID5229860

未命名化合物

HCID58117006

未命名化合物

PRODUCTS

生成物

结构：Nc1ccccc1NC(=O)c1nc2c(s1)CN(C(=O)CNc1ccc3c(c1)OCO3)CC2

HCID66865008

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cb7c077ce93f45f28390915badc0568d
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

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