HRID1132160

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

HCID67776152

未命名化合物

结构：CN(CC1OC(n2cnc3c(N)ncnc32)C2OC(C)(C)OC12)C1CC(CCC(=O)O)C1

HCID77352971

未命名化合物

PRODUCTS

生成物

结构：CN(CC1OC(n2cnc3c(N)ncnc32)C2OC(C)(C)OC12)C1CC(CCC(=O)Nc2cc(C3COC3)ccc2N)C1

HCID77353040

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c831bc34cd2040078daf09ead618015d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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