HRID320295

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID4962506

2-Oxoindoline-5-sulfonyl chloride

C8H6ClNO3S

结构：CC(C)CNCC(O)C(Cc1ccccc1)NC(=O)OC1COC2OCCC12

HCID21055240

未命名化合物

PRODUCTS

生成物

结构：CC(C)CN(CC(O)C(Cc1ccccc1)NC(=O)OC1COC2OCCC12)S(=O)(=O)c1ccc2c(c1)CC(=O)N2

HCID58612411

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-adb872294dc14b9e82cfee373d0eb301
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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