HRID119904

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID4837

Piperazine

C4H10N2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

结构：CC(=O)N(C1CCC(C)(C)CC1)C1CC(C(=O)O)N(C(=O)OC(C)(C)C)C1

HCID178474145

未命名化合物

PRODUCTS

生成物

结构：CC(=O)N(C1CCC(C)(C)CC1)C1CC(C(=O)N2CCNCC2)N(C(=O)OC(C)(C)C)C1

HCID178474143

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-602d76b7cec74be8bf88d40f5b24149b
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](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH:9]([C:10](=[O:11])[OH:12])[CH2:13][CH:14]([N:16]([CH:17]2[CH2:18][CH2:19][C:20]([CH3:23])([CH3:24])[CH2:21][CH2:22]2)[C:25]([CH3:26])=[O:27])[CH2:15]1.[CH2:37]1[CH2:38][NH:39][CH2:40][CH2:41][NH:42]1.[CH:28]([N:29]([CH2:30][CH3:31])[CH:32]([CH3:33])[CH3:34])([CH3:35])[CH3:36].[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[P-:43]([F:44])([F:45])([F:46])([F:47])([F:48])[F:49].[n:50]1([O:51][C:52]([N:53]([CH3:54])[CH3:55])=[N+:56]([CH3:57])[CH3:58])[c:59]2[cH:60][cH:61][cH:62][cH:63][c:64]2[n:65][n:66]1>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH:9]([C:10](=[O:12])[N:39]2[CH2:38][CH2:37][NH:42][CH2:41][CH2:40]2)[CH2:13][CH:14]([N:16]([CH:17]2[CH2:18][CH2:19][C:20]([CH3:23])([CH3:24])[CH2:21][CH2:22]2)[C:25]([CH3:26])=[O:27])[CH2:15]1