HRID691612

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID21241

1-Butene, 4-bromo-

C4H7Br

HCID28486

Lithium ion

Li+

HCID3280088

未命名化合物

结构：Fc1cc(C2OCCCO2)ccc1-c1nc2ccc(Cc3ccccc3)nc2s1

HCID59174872

未命名化合物

PRODUCTS

生成物

结构：C=CCCC(c1ccccc1)c1ccc2nc(-c3ccc(C4OCCCO4)cc3F)sc2n1

HCID68635987

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-052ed3d6891c47dd8b4bb18a7e2b84f0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[Br:45][CH2:46][CH2:47][CH:48]=[CH2:49].[CH2:40]1[CH2:41][CH2:42][CH2:43][O:44]1.[CH3:31][Si:32]([N-:33][Si:34]([CH3:35])([CH3:36])[CH3:37])([CH3:38])[CH3:39].[Li+:30].[O:1]1[CH:2]([c:7]2[cH:8][c:9]([F:29])[c:10](-[c:13]3[s:14][c:15]4[n:16][c:17]([CH2:22][c:23]5[cH:24][cH:25][cH:26][cH:27][cH:28]5)[cH:18][cH:19][c:20]4[n:21]3)[cH:11][cH:12]2)[O:3][CH2:4][CH2:5][CH2:6]1.[O:50]=[CH:51][N:52]([CH3:53])[CH3:54]>>[O:1]1[CH:2]([c:7]2[cH:8][c:9]([F:29])[c:10](-[c:13]3[s:14][c:15]4[n:16][c:17]([CH:22]([c:23]5[cH:24][cH:25][cH:26][cH:27][cH:28]5)[CH2:43][CH2:42][CH:41]=[CH2:40])[cH:18][cH:19][c:20]4[n:21]3)[cH:11][cH:12]2)[O:3][CH2:4][CH2:5][CH2:6]1