HRID953816

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID8471

Triethylamine

C6H15N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID409140

Benzyl 2-aminoacetate

C9H11NO2

HCID8520682

Cyanomethyl 3-[[(1,1-dimethylethoxy)carbonyl]amino]benzoate

C14H16N2O4

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)Nc1cccc(C(=O)NCC(=O)OCc2ccccc2)c1

HCID15670374

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6d6578c911d24df5b180fdb855be4dcb
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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