HRID105991

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID260

Hydrogen Bromide

BrH

HCID6344

Dichloromethane

CH2Cl2

HCID11492

3-Tyramine

C8H11NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID69325374

未命名化合物

PRODUCTS

生成物

结构：CSC(C(C)C(=O)NCCc1cccc(O)c1)C1CCCN1C(=O)OC(C)(C)C

HCID178503682

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6591526d5c4c4c2781c054f7958a5b21
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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