HRID693982

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID6329

Methylamine

CH5N

HCID8028

Tetrahydrofuran

C4H8O

结构：CCC(C)C(NC(=O)C1CCCCN1C)C(=O)N(C)C(CC(O)c1nc(C(=O)OC)cs1)C(C)C

HCID59515971

未命名化合物

PRODUCTS

生成物

结构：CCC(C)C(NC(=O)C1CCCCN1C)C(=O)N(C)C(CC(O)c1nc(C(=O)NC)cs1)C(C)C

HCID66839641

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-249448ea387b4ebabbe47b10bb7f4d96
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:1][NH2:2].[CH3:3][O:4][C:5](=[O:6])[c:7]1[n:8][c:9]([CH:12]([CH2:13][CH:14]([CH:15]([CH3:16])[CH3:17])[N:18]([C:19]([CH:20]([CH:21]([CH2:22][CH3:23])[CH3:24])[NH:25][C:26](=[O:27])[CH:28]2[N:29]([CH3:34])[CH2:30][CH2:31][CH2:32][CH2:33]2)=[O:35])[CH3:36])[OH:37])[s:10][cH:11]1.[CH3:43][OH:44]>>[CH3:1][NH:2][C:5](=[O:6])[c:7]1[n:8][c:9]([CH:12]([CH2:13][CH:14]([CH:15]([CH3:16])[CH3:17])[N:18]([C:19]([CH:20]([CH:21]([CH2:22][CH3:23])[CH3:24])[NH:25][C:26](=[O:27])[CH:28]2[N:29]([CH3:34])[CH2:30][CH2:31][CH2:32][CH2:33]2)=[O:35])[CH3:36])[OH:37])[s:10][cH:11]1