HRID671843

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID6484228

Thiomorpholine 1,1-dioxide

C4H9NO2S

结构：CC(C)n1c(C(=O)O)cc2cc(C(=O)N3CCCN(C(=O)OC(C)(C)C)CC3)ccc21

HCID68538212

未命名化合物

PRODUCTS

生成物

结构：CC(C)n1c(C(=O)N2CCS(=O)(=O)CC2)cc2cc(C(=O)N3CCCN(C(=O)OC(C)(C)C)CC3)ccc21

HCID68684748

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7f220cdd12cf4b09b46cff362f221c01
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([C:15](=[O:16])[c:17]2[cH:18][c:19]3[cH:20][c:21]([C:29](=[O:30])[OH:31])[n:22]([CH:26]([CH3:27])[CH3:28])[c:23]3[cH:24][cH:25]2)[CH2:12][CH2:13][CH2:14]1.[CH2:41]([N:42]=[C:43]=[N:44][CH2:45][CH2:46][CH2:47][N:48]([CH3:49])[CH3:50])[CH3:51].[ClH:40].[S:32]1(=[O:38])(=[O:39])[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([C:15](=[O:16])[c:17]2[cH:18][c:19]3[cH:20][c:21]([C:29](=[O:30])[N:35]4[CH2:34][CH2:33][S:32](=[O:38])(=[O:39])[CH2:37][CH2:36]4)[n:22]([CH:26]([CH3:27])[CH3:28])[c:23]3[cH:24][cH:25]2)[CH2:12][CH2:13][CH2:14]1