HRID1133536

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6598

Dimethylcarbamoyl chloride

C3H6ClNO

结构：CC(C)N1CCC(Oc2ccc3c(c2)cc(C(=O)N2CCNCC2)n3C(C)C)CC1

HCID68565610

未命名化合物

PRODUCTS

生成物

结构：CC(C)N1CCC(Oc2ccc3c(c2)cc(C(=O)N2CCN(C(=O)N(C)C)CC2)n3C(C)C)CC1

HCID68563724

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2f7dc6252ce844908197ef23160c03d5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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