HRID213875

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID736817

1-Boc-4-(aminomethyl)piperidine

C11H22N2O2

HCID1653580

1-(Propan-2-yl)-1,3-dihydro-2H-benzimidazol-2-one

C10H12N2O

PRODUCTS

生成物

结构：CC(C)n1c(=O)n(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21

HCID59428174

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1548d242330c4ac29646e363a433d5fe
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:14][CH2:15][N:16]([CH2:17][CH3:18])[CH2:19][CH3:20].[CH:1]([CH3:2])([CH3:3])[n:4]1[c:5](=[O:13])[nH:6][c:7]2[c:8]1[cH:9][cH:10][cH:11][cH:12]2.[NH2:21][CH2:22][CH:23]1[CH2:24][CH2:25][N:26]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:27][CH2:28]1.[Na+:40].[O-:36][C:37]([OH:38])=[O:39].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1>>[CH:1]([CH3:2])([CH3:3])[n:4]1[c:5](=[O:13])[n:6]([C:37]([NH:21][CH2:22][CH:23]2[CH2:24][CH2:25][N:26]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:27][CH2:28]2)=[O:36])[c:7]2[c:8]1[cH:9][cH:10][cH:11][cH:12]2