HRID807812

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID23432608

未命名化合物

结构：CC1NC(C(O)C(N)Cc2cc(F)cc(F)c2)COC1OCC(C)(CF)CF

HCID178432981

未命名化合物

PRODUCTS

生成物

结构：CC(C)Sc1cc(F)cc(CC(N)C(O)C2COC(OCC(C)(CF)CF)C(C)N2)c1

HCID178460740

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1e076be3e8c44a8691bde39d696069e6
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

[CH3:29][CH:30]([CH3:31])[S-:32].[CH3:36][N:37]1[C:38](=[O:39])[CH2:40][CH2:41][CH2:42]1.[CH3:43][OH:44].[Cl-:34].[NH2:1][CH:2]([CH:3]([OH:4])[CH:5]1[CH2:6][O:7][CH:8]([O:12][CH2:13][C:14]([CH3:15])([CH2:16][F:17])[CH2:18][F:19])[CH:9]([CH3:11])[NH:10]1)[CH2:20][c:21]1[cH:22][c:23]([F:28])[cH:24][c:25]([F:27])[cH:26]1.[NH4+:35].[Na+:33]>>[NH2:1][CH:2]([CH:3]([OH:4])[CH:5]1[CH2:6][O:7][CH:8]([O:12][CH2:13][C:14]([CH3:15])([CH2:16][F:17])[CH2:18][F:19])[CH:9]([CH3:11])[NH:10]1)[CH2:20][c:21]1[cH:22][c:23]([S:32][CH:30]([CH3:29])[CH3:31])[cH:24][c:25]([F:27])[cH:26]1