HRID665015

反应详情

EQUATION

反应方程式

REACTANTS

反应物

反应SMILES：CC1(C)C2CCC1(CS(=O)(=O)O)C(=O)C2

HCID18462

DL-10-Camphorsulfonic acid

C10H16O4S

反应SMILES：Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)N1CCC(C(=N)NO)(c2ccc(Cl)cc2)CC1

HCID178427939

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)N1CCC(C(N)=O)(c2ccc(Cl)cc2)CC1

HCID57805577

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-6ed211b3ab1545a79601b101c437e829
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

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