HRID2330443

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID8471

Triethylamine

C6H15N

HCID10728523

未命名化合物

HCID22259036

Phenyl (5-acetyl-4-methyl-1,3-thiazol-2-yl)carbamate

C13H12N2O3S

PRODUCTS

生成物

结构：CC(=O)c1sc(NC(=O)NCC2CCCN(CCc3ccc(F)cc3)C2)nc1C

HCID86591718

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6743c2d4bba14615a3d70b7e77d75f36
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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