HRID1227028

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

结构：c1ccc2c(c1)nnn2O[P+](N1CCCC1)(N1CCCC1)N1CCCC1

HCID2724700

未命名化合物

HCID11229817

未命名化合物

结构：CCOC(=O)C(C)=CC(C(C)C)N(C)C(=O)C(N)C(C)(C)C

HCID73735333

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(C)=CC(C(C)C)N(C)C(=O)C(NC(=O)C(NC)C12CC3CC(CC(C3)C1)C2)C(C)(C)C

HCID178471379

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-116dde8164694ec4b84c5d3a9741646a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:1]12([CH:11]([C:12](=[O:13])[OH:14])[NH:15][CH3:16])[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2.[CH3:50][C:51]([C:52](=[O:53])[O:54][CH2:55][CH3:56])=[CH:57][CH:58]([CH:59]([CH3:60])[CH3:61])[N:62]([C:63]([CH:64]([NH2:65])[C:66]([CH3:67])([CH3:68])[CH3:69])=[O:70])[CH3:71].[CH:72]([N:73]([CH:74]([CH3:75])[CH3:76])[CH2:77][CH3:78])([CH3:79])[CH3:80].[Cl:81][CH2:82][Cl:83].[P-:17]([F:18])([F:19])([F:20])([F:21])([F:22])[F:23].[n:24]1([O:25][P+:26]([N:27]2[CH2:28][CH2:29][CH2:30][CH2:31]2)([N:32]2[CH2:33][CH2:34][CH2:35][CH2:36]2)[N:37]2[CH2:38][CH2:39][CH2:40][CH2:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][c:47]2[n:48][n:49]1>>[C:1]12([CH:11]([C:12](=[O:14])[NH:65][CH:64]([C:63]([N:62]([CH:58]([CH:57]=[C:51]([CH3:50])[C:52](=[O:53])[O:54][CH2:55][CH3:56])[CH:59]([CH3:60])[CH3:61])[CH3:71])=[O:70])[C:66]([CH3:67])([CH3:68])[CH3:69])[NH:15][CH3:16])[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2