HRID86110

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

HCID2735821

4-Chlorothieno[3,2-d]pyrimidine

C6H3ClN2S

HCID45117855

tert-Butyl [5-(2-aminoethyl)-1,3-thiazol-2-yl]carbamate

C10H17N3O2S

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)Nc1ncc(CCNc2ncnc3ccsc23)s1

HCID86603168

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-274f7aeed8694fc2823312f372c59cfb
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[s:9][c:10]([CH2:13][CH2:14][NH2:15])[cH:11][n:12]1)=[O:16].[CH3:36][N:37]([CH3:38])[CH:39]=[O:40].[CH3:41][CH2:42][O:43][C:44]([CH3:45])=[O:46].[CH:27]([N:28]([CH2:29][CH3:30])[CH:31]([CH3:32])[CH3:33])([CH3:34])[CH3:35].[Cl:17][c:18]1[c:19]2[c:20]([n:21][cH:22][n:23]1)[cH:24][cH:25][s:26]2.[OH2:47]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[s:9][c:10]([CH2:13][CH2:14][NH:15][c:18]2[c:19]3[c:20]([n:21][cH:22][n:23]2)[cH:24][cH:25][s:26]3)[cH:11][n:12]1)=[O:16]