HRID87068

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID21889798

1-Benzylcyclopropane-1-sulfonamide

C10H13NO2S

结构：CC(C)(C)OC(=O)NC1CCCCCC=CC2CC2(C(=O)O)NC(=O)C2CC(Oc3nccc4ccccc34)CN2C1=O

HCID72427434

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1CCCCCC=CC2CC2(C(=O)NS(=O)(=O)C2(Cc3ccccc3)CC2)NC(=O)C2CC(Oc3nccc4ccccc34)CN2C1=O

HCID68751787

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ba7b1e0485814851bac7edd293129c74
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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