HRID2137534

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID8857

Ethyl Acetate

C4H8O2

HCID24499

Amidosulfonic acid chloride

H2ClNO2S

HCID31374

Dimethylacetamide

C4H9NO

HCID21976910

未命名化合物

PRODUCTS

产物

HCID11538931

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-cdec5eaa84ab4e8290e757492511d453
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

[C:44]([N:45]([CH3:46])[CH3:47])(=[O:48])[CH3:49].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[CH3:6][c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1.[OH2:37].[OH:13][c:14]1[cH:15][c:16]([S:20][CH2:21][CH2:22][N:23]([c:24]2[cH:25][cH:26][c:27]([C:28]#[N:29])[cH:30][cH:31]2)[n:32]2[cH:33][n:34][n:35][cH:36]2)[cH:17][cH:18][cH:19]1.[S:1]([NH2:2])(=[O:3])(=[O:4])[Cl:5]>>[S:1]([NH2:2])(=[O:3])(=[O:4])[O:13][c:14]1[cH:15][c:16]([S:20][CH2:21][CH2:22][N:23]([c:24]2[cH:25][cH:26][c:27]([C:28]#[N:29])[cH:30][cH:31]2)[n:32]2[cH:33][n:34][n:35][cH:36]2)[cH:17][cH:18][cH:19]1