HRID121051

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

反应SMILES：Cc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)nc2[nH]c(-c3c(NCC(O)c4cccc(Cl)c4)cc[nH]c3=O)nc12

HCID178433097

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1nc(N2CCNCC2)nc2[nH]c(-c3c(NCC(O)c4cccc(Cl)c4)cc[nH]c3=O)nc12

HCID178433088

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-fc03952181cb4f9db27f8938e0b81578
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]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[n:15][c:16]([CH3:41])[c:17]3[n:18][c:19](-[c:23]4[c:24](=[O:40])[nH:25][cH:26][cH:27][c:28]4[NH:29][CH2:30][CH:31]([OH:32])[c:33]4[cH:34][c:35]([Cl:39])[cH:36][cH:37][cH:38]4)[nH:20][c:21]3[n:22]2)[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[Cl:42][CH2:43][Cl:44]>>[NH:8]1[CH2:9][CH2:10][N:11]([c:14]2[n:15][c:16]([CH3:41])[c:17]3[n:18][c:19](-[c:23]4[c:24](=[O:40])[nH:25][cH:26][cH:27][c:28]4[NH:29][CH2:30][CH:31]([OH:32])[c:33]4[cH:34][c:35]([Cl:39])[cH:36][cH:37][cH:38]4)[nH:20][c:21]3[n:22]2)[CH2:12][CH2:13]1