HRID173964

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID15765418

Cyclopropanesulfonamide

C3H7NO2S

反应SMILES：CCOc1nc(OC2CC3C(=O)NC4(C(=O)O)CC4C=CCCCCN(C)C(=O)C3C2)c2ccc(OC)c(C)c2n1

HCID68409293

未命名化合物

PRODUCTS

产物

反应SMILES：CCOc1nc(OC2CC3C(=O)NC4(C(=O)NS(=O)(=O)C5CC5)CC4C=CCCCCN(C)C(=O)C3C2)c2ccc(OC)c(C)c2n1

HCID68689567

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-8a8fb5f2c8ae42b49be6eb78962ea458
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

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