HRID214817

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID78288

Glycine, N-[(1,1-dimethylethoxy)carbonyl]-

C7H13NO4

HCID16244568

1-[(4-Chlorophenyl)methyl]pyrrolidin-3-amine

C11H15ClN2

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NCC(=O)NC1CCN(Cc2ccc(Cl)cc2)C1

HCID18426195

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-66d4cdafcdb147798f7a569fbd54e21f
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

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