HRID108263

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID79872

4-Morpholinebutanoic acid (9CI)

C8H15NO3

结构：CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)S1

HCID3043883

2,4,4-Trimethyl-7-(3-methyloctan-2-yl)-1,4-dihydro-2H-thieno[2,3-c][1]benzopyran-9-ol

C23H34O2S

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：CCCCCC(C)C(C)c1cc(OC(=O)CCCN2CCOCC2)c2c(c1)OC(C)(C)C1=C2CC(C)S1

HCID21520001

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cf441be5707440879383da97996e228f
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

[CH2:55]([Cl:56])[Cl:57].[CH3:1][CH:2]1[CH2:3][C:4]2=[C:5]([C:6]([CH3:24])([CH3:25])[O:7][c:8]3[c:9]2[c:10]([OH:23])[cH:11][c:12]([CH:14]([CH3:15])[CH:16]([CH2:17][CH2:18][CH2:19][CH2:20][CH3:21])[CH3:22])[cH:13]3)[S:26]1.[CH:27]1([N:28]=[C:29]=[N:30][CH:31]2[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]2)[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]1.[ClH:42].[O:43]1[CH2:44][CH2:45][N:46]([CH2:49][CH2:50][CH2:51][C:52](=[O:53])[OH:54])[CH2:47][CH2:48]1>>[CH3:1][CH:2]1[CH2:3][C:4]2=[C:5]([C:6]([CH3:24])([CH3:25])[O:7][c:8]3[c:9]2[c:10]([O:23][C:52]([CH2:51][CH2:50][CH2:49][N:46]2[CH2:45][CH2:44][O:43][CH2:48][CH2:47]2)=[O:53])[cH:11][c:12]([CH:14]([CH3:15])[CH:16]([CH2:17][CH2:18][CH2:19][CH2:20][CH3:21])[CH3:22])[cH:13]3)[S:26]1.[ClH:42]