HRID289388

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6180

N-Acetyl-methionine

C7H13NO3S

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID31374

Dimethylacetamide

C4H9NO

HCID62365

Isobutyl chloroformate

C5H9ClO2

HCID178507442

未命名化合物

PRODUCTS

生成物

结构：CSCCC(NC(C)=O)C(=O)Nc1ccc(-c2ncc(C(=O)O)c(O)n2)cc1

HCID178503723

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-427600e35f794480b52be37f443d7a98
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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