HRID189024

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8857

Ethyl Acetate

C4H8O2

HCID14284

4-(Dimethylamino)pyridine

C7H10N2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID22784

Benzenesulfonamide, 4-nitro-

C6H6N2O4S

HCID18973764

未命名化合物

PRODUCTS

产物

HCID18973867

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-299abf7bf638431a9aa61f511eb07dc1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应SMILES

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