HRID160888

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID8471

Triethylamine

C6H15N

HCID96923

1-Hexadecanesulfonyl chloride

C16H33ClO2S

结构：CC(C)CCCC(C)C1CCC2C3CCC4CC(N5CC(O)C5)CCC4(C)C3CCC12C

HCID178442577

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCCCCCCCCCS(=O)(=O)OC1CN(C2CCC3(C)C(CCC4C3CCC3(C)C(C(C)CCCC(C)C)CCC43)C2)C1

HCID178443130

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-67511f850fa7411d92c0cda82b0cb2ca
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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