HRID152160

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID77743

1-Propanamine, 3-(methylthio)-

C4H11NS

结构：CC(C)(C)OC(=O)N1C(C(=O)O)CSC1c1cccnc1

HCID14772789

未命名化合物

PRODUCTS

生成物

结构：CSCCCNC(=O)C1CSC(c2cccnc2)N1C(=O)OC(C)(C)C

HCID20074052

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d00cbf53244a495ab18444e9ba8e8caf
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])[O:5][C:6](=[O:7])[N:8]1[CH:9]([c:16]2[cH:17][n:18][cH:19][cH:20][cH:21]2)[S:10][CH2:11][CH:12]1[C:13](=[O:14])[OH:15].[CH3:22][S:23][CH2:24][CH2:25][CH2:26][NH2:27].[CH:38]1([N:39]=[C:40]=[N:41][CH:42]2[CH2:43][CH2:44][CH2:45][CH2:46][CH2:47]2)[CH2:48][CH2:49][CH2:50][CH2:51][CH2:52]1.[O:53]1[CH2:54][CH2:55][CH2:56][CH2:57]1.[OH:28][n:29]1[c:30]2[cH:31][cH:32][cH:33][cH:34][c:35]2[n:36][n:37]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([c:16]2[cH:17][n:18][cH:19][cH:20][cH:21]2)[S:10][CH2:11][CH:12]1[C:13](=[O:15])[NH:27][CH2:26][CH2:25][CH2:24][S:23][CH3:22]