HRID959219

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID8082

Piperidine

C5H11N

HCID8857

Ethyl acetate

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

HCID94429

Triphosgene

C3Cl6O3

结构：CCOC(=O)n1nc(N)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2

HCID57353085

5-tert-Butyl 1-ethyl 3-amino-6,6-dimethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-1,5-dicarboxylate

C15H24N4O4

PRODUCTS

生成物

结构：CCOC(=O)n1nc(NC(=O)N2CCCCC2)c2c1C(C)(C)N(C(=O)OC(C)(C)C)C2

HCID68649686

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2c031091e40344779316007a2cf682b1
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

[CH2:45]1[CH2:46][CH2:47][NH:48][CH2:49][CH2:50]1.[CH3:56][CH2:57][O:58][C:59]([CH3:60])=[O:61].[CH3:62][CH2:63][CH2:64][CH2:65][CH2:66][CH3:67].[CH:36]([N:37]([CH2:38][CH3:39])[CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[Cl:1][C:2]([Cl:3])([O:4][C:5]([O:6][C:7]([Cl:8])([Cl:9])[Cl:10])=[O:11])[Cl:12].[NH2:13][c:14]1[c:15]2[c:16]([n:17]([C:19](=[O:20])[O:21][CH2:22][CH3:23])[n:18]1)[C:24]([CH3:34])([CH3:35])[N:25]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH2:26]2.[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1>>[C:5](=[O:11])([NH:13][c:14]1[c:15]2[c:16]([n:17]([C:19](=[O:20])[O:21][CH2:22][CH3:23])[n:18]1)[C:24]([CH3:34])([CH3:35])[N:25]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH2:26]2)[N:48]1[CH2:47][CH2:46][CH2:45][CH2:50][CH2:49]1