HRID134547

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID21906542

未命名化合物

结构：CC(C)(C)OC(=O)N1CCC(Oc2cc(C(C)(C)C)ccc2C(=O)Cl)CC1

HCID86610260

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(C(C)(C)C)cc2OC2CCN(C(=O)OC(C)(C)C)CC2)nc1

HCID68532906

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-52d0c1ff968144938df9822ea40fbec9
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

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