HRID933406

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID7972

4-Methylmorpholine

C5H11NO

HCID8028

Tetrahydrofuran

C4H8O

HCID2734060

未命名化合物

HCID66855738

N-[4-(1-Aminoethyl)-2,6-difluorophenyl]methanesulfonamide

C9H12F2N2O2S

HCID66855885

未命名化合物

PRODUCTS

生成物

结构：CCCc1cc(C(F)(F)F)ccc1C=CC(=O)NC(C)c1cc(F)c(NS(C)(=O)=O)c(F)c1

HCID66856893

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d0dc129dbc3047ada2a307f8abd3d878
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

[CH2:25]([CH2:26][CH3:27])[c:28]1[c:29]([CH:38]=[CH:39][C:40](=[O:41])[OH:42])[cH:30][cH:31][c:32]([C:34]([F:35])([F:36])[F:37])[cH:33]1.[CH2:62]1[O:63][CH2:64][CH2:65][CH2:66]1.[CH3:18][N:19]1[CH2:20][CH2:21][O:22][CH2:23][CH2:24]1.[CH3:45][O:46][c:47]1[n:48][c:49]([O:50][CH3:51])[n:52][c:53]([N+:54]2([CH3:55])[CH2:56][CH2:57][O:58][CH2:59][CH2:60]2)[n:61]1.[Cl-:44].[ClH:17].[NH2:1][CH:2]([CH3:3])[c:4]1[cH:5][c:6]([F:16])[c:7]([NH:11][S:12](=[O:13])(=[O:14])[CH3:15])[c:8]([F:10])[cH:9]1.[OH2:43]>>[NH:1]([CH:2]([CH3:3])[c:4]1[cH:5][c:6]([F:16])[c:7]([NH:11][S:12](=[O:13])(=[O:14])[CH3:15])[c:8]([F:10])[cH:9]1)[C:40]([CH:39]=[CH:38][c:29]1[c:28]([CH2:25][CH2:26][CH3:27])[cH:33][c:32]([C:34]([F:35])([F:36])[F:37])[cH:31][cH:30]1)=[O:41]