HRID187306

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID408285

2-Morpholinoethylamine

C6H14N2O

HCID22143506

Benzo[b]thiophene-3-carboxylic acid, 2-methyl-6-(thieno[3,2-b]pyridin-7-yloxy)-

C17H11NO3S2

PRODUCTS

生成物

结构：Cc1sc2cc(Oc3ccnc4ccsc34)ccc2c1C(=O)NCCN1CCOCC1

HCID20767808

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3b8d016e3d9b4c848a2ee8113f08f0ab
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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