HRID820456

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

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+

HCID5046859

未命名化合物

结构：COC(=O)C1CC(SC)(c2ccc(-c3ccccc3)cc2)CN1

HCID67030651

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C1CC(SC)(c2ccc(-c3ccccc3)cc2)CN1C(=O)C(NC(=O)OC(C)(C)C)C(C)(C)C

HCID178498622

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8969464f1a744183b5d36e349e29f6b3
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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