HRID1556753

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID2775139

2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetic acid

C12H11NO3

HCID2776360

1-(4-Benzylmorpholin-2-yl)methanamine

C12H18N2O

PRODUCTS

生成物

结构：Cc1oc(-c2ccccc2)nc1CC(=O)NCC1CN(Cc2ccccc2)CCO1

HCID21962873

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-aff4768904984335805231ba9c8c3927
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH2:48]([c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1)[N:55]1[CH2:56][CH:57]([CH2:61][NH2:62])[O:58][CH2:59][CH2:60]1.[CH3:1][c:2]1[c:3]([CH2:13][C:14](=[O:15])[OH:16])[n:4][c:5](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[o:6]1.[CH3:37][N:38]([CH3:39])[CH2:40][CH2:41][CH2:42][N:43]=[C:44]=[N:45][CH2:46][CH3:47].[CH3:63][N:64]([CH3:65])[CH:66]=[O:67].[CH:27]([N:28]([CH2:29][CH3:30])[CH:31]([CH3:32])[CH3:33])([CH3:34])[CH3:35].[ClH:36].[OH:17][n:18]1[c:19]2[cH:20][cH:21][cH:22][cH:23][c:24]2[n:25][n:26]1>>[CH3:1][c:2]1[c:3]([CH2:13][C:14](=[O:16])[NH:62][CH2:61][CH:57]2[CH2:56][N:55]([CH2:48][c:49]3[cH:50][cH:51][cH:52][cH:53][cH:54]3)[CH2:60][CH2:59][O:58]2)[n:4][c:5](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[o:6]1