HRID807204

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID9321

Hydrazine

H4N2

结构：COc1ccccc1N(CCN1CCC(C(=O)c2ccc(F)cc2)CC1)S(=O)(=O)c1ccc(CN2C(=O)c3ccccc3C2=O)cc1

HCID19689983

N-{2-[4-(4-Fluorobenzoyl)piperidino]ethyl}-N-(2-methoxyphenyl)-4-phthalimidomethylbenzenesulfonamide

C36H34FN3O6S

PRODUCTS

生成物

结构：COc1ccccc1N(CCN1CCC(C(=O)c2ccc(F)cc2)CC1)S(=O)(=O)c1ccc(CN)cc1

HCID19689807

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5351e1386c6b456a95375713e7c4ee05
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:51](=[O:52])([OH:53])[O-:54].[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[CH:8]2[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][N:16]([S:17](=[O:18])(=[O:19])[c:20]3[cH:21][cH:22][c:23]([CH2:26][N:27]4[C:28](=[O:29])[c:30]5[cH:31][cH:32][cH:33][cH:34][c:35]5[C:36]4=[O:37])[cH:24][cH:25]3)[c:38]3[c:39]([O:44][CH3:45])[cH:40][cH:41][cH:42][cH:43]3)[CH2:12][CH2:13]2)[cH:46][cH:47]1.[NH2:49][NH2:50].[Na+:55].[OH2:48]>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[CH:8]2[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][N:16]([S:17](=[O:18])(=[O:19])[c:20]3[cH:21][cH:22][c:23]([CH2:26][NH2:27])[cH:24][cH:25]3)[c:38]3[c:39]([O:44][CH3:45])[cH:40][cH:41][cH:42][cH:43]3)[CH2:12][CH2:13]2)[cH:46][cH:47]1