HRID91933

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID9886

Hexafluorophosphate ion

F6P-

HCID4641409

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

C10H15N6O+

HCID12501433

未命名化合物

HCID14424857

1-Methyl-2-oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid

C9H8N2O3

结构：O=C(c1ccc2[nH]cnc2c1)N1CCCC2c3ccccc3CCC21

HCID178519346

未命名化合物

PRODUCTS

生成物

结构：Cn1c(=O)[nH]c2cc(C(=O)N3CCCC4c5ccccc5CC43)ccc21

HCID67223380

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-63cc19104a4847759211afda1cebceef
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

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