HRID1208653

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID78645

2-Hydrazinopyridine

C5H7N3

HCID81531

Diisopropylethylamine

C8H19N

HCID94239

Methyl prolinate

C6H11NO2

HCID17791209

未命名化合物

PRODUCTS

生成物

结构：CCC(C)(C)C(=O)C(=O)N1CCCC1C(=O)NNc1ccccn1

HCID10268491

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-70a6be5e1552448a86d3027d1fdde89f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:53]1[O:54][CH2:55][CH2:56][CH2:57]1.[CH3:18][O:19][C:20](=[O:21])[CH:22]1[CH2:23][CH2:24][CH2:25][NH:26]1.[CH3:44][N:45]([c:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1)[CH3:52].[CH3:58][CH2:59][O:60][C:61](=[O:62])[CH3:63].[CH:35]([N:36]([CH2:37][CH3:38])[CH:39]([CH3:40])[CH3:41])([CH3:42])[CH3:43].[NH:27]([NH2:28])[c:29]1[n:30][cH:31][cH:32][cH:33][cH:34]1.[O:1]=[C:2]([C:3]([C:4]([CH2:5][CH3:6])([CH3:7])[CH3:8])=[O:9])[N:10]1[CH:11]([C:15](=[O:16])[OH:17])[CH2:12][CH2:13][CH2:14]1.[OH2:64]>>[O:1]=[C:2]([C:3]([C:4]([CH2:5][CH3:6])([CH3:7])[CH3:8])=[O:9])[N:10]1[CH:11]([C:15](=[O:17])[NH:28][NH:27][c:29]2[n:30][cH:31][cH:32][cH:33][cH:34]2)[CH2:12][CH2:13][CH2:14]1