HRID936641

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID8857

Ethyl acetate

C4H8O2

HCID81669

1-(2-Chloroethyl)pyrrolidine

C6H12ClN

反应SMILES：CC(C)(C)OC(=O)N1CCC(c2nc(CCC(F)(F)F)c[nH]2)CC1

HCID178451800

未命名化合物

PRODUCTS

产物

反应SMILES：CC(C)(C)OC(=O)N1CCC(c2nc(CCC(F)(F)F)cn2CCN2CCCC2)CC1

HCID67112062

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-576b34af773742f0ad431a11ca4505fb
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应SMILES

[CH3:36][S:37](=[O:38])[CH3:39].[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[Cl:28][CH2:29][CH2:30][N:31]1[CH2:32][CH2:33][CH2:34][CH2:35]1.[ClH:27].[F:1][C:2]([CH2:3][CH2:4][c:5]1[n:6][c:7]([CH:10]2[CH2:11][CH2:12][N:13]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:14][CH2:15]2)[nH:8][cH:9]1)([F:23])[F:24].[K+:26].[OH-:25]>>[F:1][C:2]([CH2:3][CH2:4][c:5]1[n:6][c:7]([CH:10]2[CH2:11][CH2:12][N:13]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:14][CH2:15]2)[n:8]([CH2:29][CH2:30][N:31]2[CH2:32][CH2:33][CH2:34][CH2:35]2)[cH:9]1)([F:23])[F:24]